N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide

C14H21N3O — CID 119475339

IUPACN-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide
SMILESCC(C(=O)NC1CCC(N)CC1)c1cccnc1
InChIInChI=1S/C14H21N3O/c1-10(11-3-2-8-16-9-11)14(18)17-13-6-4-12(15)5-7-13/h2-3,8-10,12-13H,4-7,15H2,1H3,(H,17,18)
InChIKeyNJQWJHDGRZVIFT-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.57
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide

N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide (PubChem CID 119475339) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide
PubChem CID119475339
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide
SMILESCC(C(=O)NC1CCC(N)CC1)c1cccnc1
InChIInChI=1S/C14H21N3O/c1-10(11-3-2-8-16-9-11)14(18)17-13-6-4-12(15)5-7-13/h2-3,8-10,12-13H,4-7,15H2,1H3,(H,17,18)
InChIKeyNJQWJHDGRZVIFT-UHFFFAOYSA-N
XLogP1.57
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methylpropyl)piperidin-4-yl]-2-pyridin-3-ylpropanamide
CID 136529734
2-pyridin-3-ylpropanehydrazide
CID 116843938
2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide
CID 62225149
4-amino-N-[(1S)-1-pyridin-3-ylethyl]cyclohexane-1-carboxamide
CID 81404724
N-(4-aminocyclohexyl)-2-(3-chlorophenyl)propanamide;hydrochloride
CID 119478530
3-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1,3-diamine
CID 81406551
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
N-cyclopropyl-2-[[(1R)-1-pyridin-3-ylethyl]amino]acetamide
CID 81404358
(2R)-2-pyridin-3-yl-N-[3-[4-(trifluoromethyl)phenyl]cyclobutyl]propanamide
CID 124733846
1-[4-[[(1S)-1-pyridin-3-ylethyl]amino]piperidin-1-yl]ethanone
CID 78950814
3-amino-N-cyclopropyl-3-pyridin-3-ylpropanamide
CID 82077122
N-(1-amino-2-cyclopropylpropan-2-yl)-2-pyridin-3-ylpropanamide;dihydrochloride
CID 119573018

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide (CID 119475339) is N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide is CC(C(=O)NC1CCC(N)CC1)c1cccnc1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide?
The InChIKey is NJQWJHDGRZVIFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10(11-3-2-8-16-9-11)14(18)17-13-6-4-12(15)5-7-13/h2-3,8-10,12-13H,4-7,15H2,1H3,(H,17,18).
What are the key properties of N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide?
N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide has a molecular weight of 247.34 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide is sourced from PubChem (CID 119475339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).