chempirical

2-Pyrimidinemethanamine

C5H7N3CAS 75985-45-4109.13 g/mol

Open in Covalent MOL file
NNNH2
Primary amine

Properties

Molecular formula
C5H7N3
Molar mass
109.13 g/mol
Exact mass
109.0640 Da
logP
-0.06Crippen estimate
Polar surface area
51.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
75985-45-4
SMILES
C1=CN=C(N=C1)CN
InChIKey
ROSKZJGILXBSFM-UHFFFAOYSA-N
InChI
InChI=1S/C5H7N3/c6-4-5-7-2-1-3-8-5/h1-3H,4,6H2

Weigh it out

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

Work with 2-Pyrimidinemethanamine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Aminomethylpyrimidine hydrochloride372118-67-7Salt

Similar compounds

2-Picolylamine3731-51-948 % similar 2-Pyrimidinemethanol42839-09-848 % similar 2-(Chloromethyl)pyrimidine hydrochloride936643-80-042 % similar 3-Methyl-2-pyridinemethanamine153936-26-641 % similar (2-Chloropyridin-3-yl)methanamine205744-14-541 % similar 2,2′-Bipyrimidine34671-83-540 % similar (3-Fluoropyridin-2-yl)methanamine dihydrochloride312904-49-738 % similar 1H-Imidazole-2-methanamine53332-80-237 % similar

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

Same formula

2-Amino-4-methylpyrimidine108-52-1 2,6-Diaminopyridine141-86-6 5-Methylpyridazin-3-amine144294-43-9 3-Amino-6-methylpyridazine18591-82-7 3-Methyl-2-pyrazinamine19838-08-5 (Pyrazin-2-ylmethyl)amine20010-99-5 5-Pyrimidinemethanamine25198-95-2 4-Amino-6-methylpyrimidine3435-28-7

Elsewhere

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