6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide

C13H20N4O — CID 115366055

IUPAC6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide
SMILESNCC1(CNc2ccc(C(N)=O)cn2)CCCC1
InChIInChI=1S/C13H20N4O/c14-8-13(5-1-2-6-13)9-17-11-4-3-10(7-16-11)12(15)18/h3-4,7H,1-2,5-6,8-9,14H2,(H2,15,18)(H,16,17)
InChIKeySQTUMOFAMQOTIY-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.11
Rot. Bonds5

About 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide

6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide (PubChem CID 115366055) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide
PubChem CID115366055
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide
SMILESNCC1(CNc2ccc(C(N)=O)cn2)CCCC1
InChIInChI=1S/C13H20N4O/c14-8-13(5-1-2-6-13)9-17-11-4-3-10(7-16-11)12(15)18/h3-4,7H,1-2,5-6,8-9,14H2,(H2,15,18)(H,16,17)
InChIKeySQTUMOFAMQOTIY-UHFFFAOYSA-N
XLogP1.11
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-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

6-[[1-(2-aminoethyl)cyclopropyl]methylamino]pyridine-3-carboxamide
CID 114759134
6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridazine-3-carboxamide
CID 113295252
N-[[1-(aminomethyl)cyclopentyl]methyl]-5-tert-butylpyridin-2-amine
CID 107875696
N-[[1-(aminomethyl)cyclohexyl]methyl]pyridin-2-amine
CID 103970402
6-[2-(propan-2-ylamino)ethylamino]pyridine-3-carboxamide
CID 62663227
1-[[(5-carbamoyl-2-pyridinyl)amino]methyl]-4-methylcyclohexane-1-carboxylic acid
CID 115441131
6-(cyclopentylamino)pyridine-3-carboxamide
CID 112722808
6-(4-hydroxybutylamino)pyridine-3-carboxamide
CID 106842705
6-(pyrrolidin-3-ylmethylamino)pyridine-3-carboxamide
CID 78990640
6-(cyclohexylamino)pyridine-3-carboxamide;hydrochloride
CID 3031414
6-(hexylamino)pyridine-3-carboxamide
CID 112722796
6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 112722784

Frequently Asked Questions

What is the IUPAC name of 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide?
The IUPAC name of 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide (CID 115366055) is 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide?
The canonical SMILES for 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide is NCC1(CNc2ccc(C(N)=O)cn2)CCCC1.
What is the InChIKey of 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide?
The InChIKey is SQTUMOFAMQOTIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c14-8-13(5-1-2-6-13)9-17-11-4-3-10(7-16-11)12(15)18/h3-4,7H,1-2,5-6,8-9,14H2,(H2,15,18)(H,16,17).
What are the key properties of 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide?
6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.11, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 115366055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).