N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide

C14H21N3O — CID 113265421

IUPACN-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide
SMILESN[C@@H]1CCCC[C@H]1NC(=O)CCc1ccncc1
InChIInChI=1S/C14H21N3O/c15-12-3-1-2-4-13(12)17-14(18)6-5-11-7-9-16-10-8-11/h7-10,12-13H,1-6,15H2,(H,17,18)/t12-,13-/m1/s1
InChIKeySAHWPBMMGLMJQI-CHWSQXEVSA-N
MW247.34 g/mol
LogP1.40
Rot. Bonds4

About N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide

N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide (PubChem CID 113265421) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide
PubChem CID113265421
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide
SMILESN[C@@H]1CCCC[C@H]1NC(=O)CCc1ccncc1
InChIInChI=1S/C14H21N3O/c15-12-3-1-2-4-13(12)17-14(18)6-5-11-7-9-16-10-8-11/h7-10,12-13H,1-6,15H2,(H,17,18)/t12-,13-/m1/s1
InChIKeySAHWPBMMGLMJQI-CHWSQXEVSA-N
XLogP1.40
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1S,2S)-2-hydroxycyclohexyl]-3-pyridin-4-ylpropanamide
CID 104957512
N-(2-aminocycloheptyl)-3-(4-methoxyphenyl)propanamide
CID 63257730
N-(3-aminocyclobutyl)-3-pyridin-4-ylpropanamide
CID 114289940
2-N-(2-pyridin-4-ylethyl)cyclohexane-1,2-diamine
CID 115118100
N-(2-aminocycloheptyl)-2-pyridin-3-ylacetamide
CID 55169173
N-[(1R,2R)-2-aminocyclohexyl]-3-(furan-2-yl)propanamide
CID 93452004
N-[2-(aminomethyl)cyclohexyl]-3-pyridin-3-ylpropanamide
CID 81483186
N-[(1R,2R)-2-aminocyclohexyl]-2-(4-methylphenyl)acetamide
CID 93451691
N-[(1R,2R)-2-aminocyclohexyl]-2-(4-bromophenyl)acetamide
CID 93452631
N-(2-aminocyclopentyl)-2-(4-hydroxyphenyl)acetamide
CID 63251734
3-(4-ethylphenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]propanamide
CID 104957177
N-(2-chlorocyclohexyl)-3-(4-methylphenyl)propanamide
CID 114301183

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide?
The IUPAC name of N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide (CID 113265421) is N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide is N[C@@H]1CCCC[C@H]1NC(=O)CCc1ccncc1.
What is the InChIKey of N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide?
The InChIKey is SAHWPBMMGLMJQI-CHWSQXEVSA-N. The full InChI is InChI=1S/C14H21N3O/c15-12-3-1-2-4-13(12)17-14(18)6-5-11-7-9-16-10-8-11/h7-10,12-13H,1-6,15H2,(H,17,18)/t12-,13-/m1/s1.
What are the key properties of N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide?
N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide has a molecular weight of 247.34 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-aminocyclohexyl]-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 113265421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).