chempirical

Tricyclo[3.3.1.13,7]decane-1-carboxamide

C11H17NOCAS 5511-18-2179.26 g/mol

Open in Covalent MOL file
H2NO

Properties

Molecular formula
C11H17NO
Molar mass
179.26 g/mol
Exact mass
179.1310 Da
Melting point
119–120 °C
logP
2.74Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
1

Identifiers

CAS number
5511-18-2
SMILES
N=C(O)C12CC3CC(CC(C3)C1)C2
InChIKey
CKBZJTAMRPPVSR-UHFFFAOYSA-N
InChI
InChI=1S/C11H17NO/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H2,12,13)

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Names and synonyms

2 names
  • 1-Adamantanecarboxamide
  • Adamantan-1-carboxamide

Work with Tricyclo[3.3.1.13,7]decane-1-carboxamide

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

1-Adamantanecarboxylic acid828-51-348 % similar 1,3-Adamantanedicarboxylic acid39269-10-840 % similar 1-Acetyladamantane1660-04-438 % similar 1-Adamantanecarbonyl chloride2094-72-638 % similar 2-Hydroxy-2-methylpropanamide13027-88-837 % similar 1-Adamantanol768-95-636 % similar 1-Adamantaneacetic acid4942-47-635 % similar Adamantyl bromomethyl ketone5122-82-735 % similar

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

Same formula

2-(Benzylamino)-2-methylpropan-1-ol10250-27-8 (R)-2-Isopropylamino-2-phenylethanol112211-92-4 Mexiletine31828-71-4 N-Methylephedrine552-79-4 3-Methyl-N-ethyl-N-(β-hydroxyethyl)aniline91-88-3

Elsewhere

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