5-Isopropyl-2-pyrimidinamine

C₇H₁₁N₃CAS 98432-17-8137.19 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₇H₁₁N₃
Molar mass: 137.19 g/mol
Exact mass: 137.0953 Da
logP: 1.18Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

98432-17-8

SMILES

CC(C)C1=CN=C(N=C1)N

InChIKey

YKVWHWNSINXNPF-UHFFFAOYSA-N

InChI

InChI=1S/C7H11N3/c1-5(2)6-3-9-7(8)10-4-6/h3-5H,1-2H3,(H2,8,9,10)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

5-(Propan-2-yl)pyrimidin-2-amine

Work with 5-Isopropyl-2-pyrimidinamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,5-Diaminopyrimidine22715-27-146 % similar 2-Amino-5-methoxypyrimidine13418-77-443 % similar 2-Amino-5-hydroxypyrimidine143489-45-642 % similar 4-Isopropylaniline99-88-741 % similar 2,6-Dibromo-4-(1-methylethyl)benzenamine10546-65-340 % similar 1,4-Diisopropylbenzene100-18-539 % similar 1,3,5-Triisopropylbenzene717-74-839 % similar 6-(Propan-2-yl)pyridin-3-amine405103-02-839 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Cyclopropyl-1-methyl-1H-pyrazol-5-amine118430-74-3 3-Amino-5-cyclobutyl-1H-pyrazole326827-21-8

Elsewhere

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