N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide

C13H19N3O — CID 106121875

IUPACN-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)NCC2CCC(N)C2)c1
InChIInChI=1S/C13H19N3O/c1-9-4-11(8-15-6-9)13(17)16-7-10-2-3-12(14)5-10/h4,6,8,10,12H,2-3,5,7,14H2,1H3,(H,16,17)
InChIKeyWKGQFOSJRAMTOR-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.25
Rot. Bonds3

About N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide

N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide (PubChem CID 106121875) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide
PubChem CID106121875
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)NCC2CCC(N)C2)c1
InChIInChI=1S/C13H19N3O/c1-9-4-11(8-15-6-9)13(17)16-7-10-2-3-12(14)5-10/h4,6,8,10,12H,2-3,5,7,14H2,1H3,(H,16,17)
InChIKeyWKGQFOSJRAMTOR-UHFFFAOYSA-N
XLogP1.25
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-aminocyclopentyl)methyl]pyrimidine-5-carboxamide
CID 106121781
N-[(1R,2R)-2-aminocyclobutyl]-5-methylpyridine-3-carboxamide
CID 175896521
N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide
CID 106121411
(E)-3-[5-[(3-methylcyclopentyl)methylcarbamoyl]-3-pyridinyl]prop-2-enoic acid
CID 107415115
N-[[(2S,5R)-1-(cyclopropylmethyl)-5-(2-morpholin-4-yl-2-oxoethyl)pyrrolidin-2-yl]methyl]-5-methylpyridine-3-carboxamide
CID 166612556
N-[2,2-dimethyl-3-[(5-methylpyridine-3-carbonyl)amino]propyl]-5-methylpyridine-3-carboxamide
CID 71994778
N-[(3-hydroxycyclopentyl)methyl]pyrimidine-5-carboxamide
CID 103280499
N-(cyclopentylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63865672
N-[(3-aminocyclohexyl)methyl]-2,4,6-trimethylbenzamide
CID 106123345
5-bromo-N-[(4-bromocyclohexyl)methyl]pyridine-3-carboxamide
CID 114148085
N-[[(3R)-1-[(3-hydroxyphenyl)methyl]piperidin-3-yl]methyl]-5-methylpyridine-3-carboxamide
CID 95211495
5-methyl-N-[(E)-pent-2-enyl]pyridine-3-carboxamide
CID 178011201

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide?
The IUPAC name of N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide (CID 106121875) is N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide?
The canonical SMILES for N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide is Cc1cncc(C(=O)NCC2CCC(N)C2)c1.
What is the InChIKey of N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide?
The InChIKey is WKGQFOSJRAMTOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-4-11(8-15-6-9)13(17)16-7-10-2-3-12(14)5-10/h4,6,8,10,12H,2-3,5,7,14H2,1H3,(H,16,17).
What are the key properties of N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide?
N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclopentyl)methyl]-5-methylpyridine-3-carboxamide is sourced from PubChem (CID 106121875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).