N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide

C15H23N3O2 — CID 115360776

IUPACN-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC2(CO)CCCC2)ccn1
InChIInChI=1S/C15H23N3O2/c1-2-16-14(20)13-9-12(5-8-17-13)18-10-15(11-19)6-3-4-7-15/h5,8-9,19H,2-4,6-7,10-11H2,1H3,(H,16,20)(H,17,18)
InChIKeyVPVCXWVLYLBXBW-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.80
Rot. Bonds6

About N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide

N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide (PubChem CID 115360776) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide
PubChem CID115360776
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCC2(CO)CCCC2)ccn1
InChIInChI=1S/C15H23N3O2/c1-2-16-14(20)13-9-12(5-8-17-13)18-10-15(11-19)6-3-4-7-15/h5,8-9,19H,2-4,6-7,10-11H2,1H3,(H,16,20)(H,17,18)
InChIKeyVPVCXWVLYLBXBW-UHFFFAOYSA-N
XLogP1.80
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide 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

1-[[2-(ethylcarbamoyl)-4-pyridinyl]amino]cyclopentane-1-carboxylic acid
CID 61289525
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 62142219
4-[[1-(aminomethyl)cyclohexyl]amino]-N-ethylpyridine-2-carboxamide
CID 63759268
N-ethyl-4-[(3-methoxyoxolan-3-yl)methylamino]pyridine-2-carboxamide
CID 104705688
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
N-ethyl-4-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-2-carboxamide
CID 79358278
4-(cycloheptylamino)-N-ethylpyridine-2-carboxamide
CID 43517906
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
4-(cyclooctylamino)-N-ethylpyridine-2-carboxamide
CID 43517873
N-ethyl-4-[(3-hydroxycyclobutyl)methylamino]pyridine-2-carboxamide
CID 66004621
4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
CID 113234707
N-benzyl-4-[(1-hydroxycyclobutyl)methylamino]pyridine-2-carboxamide
CID 133329833

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide (CID 115360776) is N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide is CCNC(=O)c1cc(NCC2(CO)CCCC2)ccn1.
What is the InChIKey of N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide?
The InChIKey is VPVCXWVLYLBXBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-2-16-14(20)13-9-12(5-8-17-13)18-10-15(11-19)6-3-4-7-15/h5,8-9,19H,2-4,6-7,10-11H2,1H3,(H,16,20)(H,17,18).
What are the key properties of N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide?
N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.80, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[1-(hydroxymethyl)cyclopentyl]methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 115360776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).