2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide

C13H19N3O2 — CID 133324096

IUPAC2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC1CCCC1O
InChIInChI=1S/C13H19N3O2/c1-14-13(18)10-5-3-7-15-12(10)16-8-9-4-2-6-11(9)17/h3,5,7,9,11,17H,2,4,6,8H2,1H3,(H,14,18)(H,15,16)
InChIKeyMDDNSCKZJPMPTI-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.01
Rot. Bonds4

About 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide

2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide (PubChem CID 133324096) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide
PubChem CID133324096
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1cccnc1NCC1CCCC1O
InChIInChI=1S/C13H19N3O2/c1-14-13(18)10-5-3-7-15-12(10)16-8-9-4-2-6-11(9)17/h3,5,7,9,11,17H,2,4,6,8H2,1H3,(H,14,18)(H,15,16)
InChIKeyMDDNSCKZJPMPTI-UHFFFAOYSA-N
XLogP1.01
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-hydroxycyclopentyl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 111540624
2-[(2-methylcyclohexyl)methylamino]pyridine-3-carboxamide
CID 55009920
2-[(2-methylcyclohexyl)methylamino]pyridine-3-carboxylic acid
CID 63511863
N-[3-cyano-4-(trifluoromethyl)phenyl]-2-[[(2R)-2-hydroxycyclopentyl]methylamino]pyridine-3-carboxamide
CID 145152890
N-methyl-2-[(1-methylcyclopentyl)methylamino]pyridine-3-carboxamide
CID 133321099
2-(1,1a,6,6a-tetrahydrocyclopropa[a]inden-1-ylmethylamino)-N-methylpyridine-3-carboxamide
CID 133375536
2-[(4-hydroxycyclohexyl)methylamino]pyridine-3-carboxamide
CID 114147498
ethyl 2-(cyclobutylmethylamino)pyridine-3-carboxylate
CID 43298774
N-methyl-2-[2-(3-methylpiperidin-1-yl)propylamino]pyridine-3-carboxamide
CID 133328259
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62168476
2-[[(5-bromoisoquinolin-1-yl)amino]methyl]cyclopentan-1-ol
CID 103847139
2-[(6-chloro-3-pyridinyl)methylamino]-N-methylpyridine-3-carboxamide
CID 133319280

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide?
The IUPAC name of 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide (CID 133324096) is 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide is CNC(=O)c1cccnc1NCC1CCCC1O.
What is the InChIKey of 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide?
The InChIKey is MDDNSCKZJPMPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-14-13(18)10-5-3-7-15-12(10)16-8-9-4-2-6-11(9)17/h3,5,7,9,11,17H,2,4,6,8H2,1H3,(H,14,18)(H,15,16).
What are the key properties of 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide?
2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.01, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxycyclopentyl)methylamino]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 133324096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).