3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine

C15H24N2 — CID 114136937

IUPAC3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
SMILESCc1cccc(CNCCCC2CCCC2)n1
InChIInChI=1S/C15H24N2/c1-13-6-4-10-15(17-13)12-16-11-5-9-14-7-2-3-8-14/h4,6,10,14,16H,2-3,5,7-9,11-12H2,1H3
InChIKeyPHBUSCZWXFNOBL-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.45
Rot. Bonds6

About 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine

3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine (PubChem CID 114136937) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
PubChem CID114136937
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
SMILESCc1cccc(CNCCCC2CCCC2)n1
InChIInChI=1S/C15H24N2/c1-13-6-4-10-15(17-13)12-16-11-5-9-14-7-2-3-8-14/h4,6,10,14,16H,2-3,5,7-9,11-12H2,1H3
InChIKeyPHBUSCZWXFNOBL-UHFFFAOYSA-N
XLogP3.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclohexyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 79267079
N-[(6-methyl-2-pyridinyl)methyl]-3-(oxolan-2-yl)propan-1-amine
CID 65163956
N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 14280569
3-cyclopentyl-N-(quinolin-2-ylmethyl)propan-1-amine
CID 103698449
N-[(6-methyl-2-pyridinyl)methyl]-3-methylsulfanylpropan-1-amine
CID 60961143
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
3-cyclopentyl-N-[(2-methylquinolin-6-yl)methyl]propan-1-amine
CID 106008790
4-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclohexan-1-ol
CID 106133296
1-(4-ethylcyclohexyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 79267415
3-cyclopentyl-N-[(2-ethylphenyl)methyl]propan-1-amine
CID 114136754
2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
CID 79267879
N-[(6-methyl-2-pyridinyl)methyl]-1-(oxolan-2-yl)methanamine
CID 60984970

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The IUPAC name of 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine (CID 114136937) is 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The canonical SMILES for 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine is Cc1cccc(CNCCCC2CCCC2)n1.
What is the InChIKey of 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The InChIKey is PHBUSCZWXFNOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-6-4-10-15(17-13)12-16-11-5-9-14-7-2-3-8-14/h4,6,10,14,16H,2-3,5,7-9,11-12H2,1H3.
What are the key properties of 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine is sourced from PubChem (CID 114136937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).