N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine

C15H25N3 — CID 62278994

IUPACN-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine
SMILESCCCNCc1cccc(N(C)C2CCCC2)n1
InChIInChI=1S/C15H25N3/c1-3-11-16-12-13-7-6-10-15(17-13)18(2)14-8-4-5-9-14/h6-7,10,14,16H,3-5,8-9,11-12H2,1-2H3
InChIKeyRKABMLGRNRCYJR-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.96
Rot. Bonds6

About N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine

N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine (PubChem CID 62278994) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine
PubChem CID62278994
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine
SMILESCCCNCc1cccc(N(C)C2CCCC2)n1
InChIInChI=1S/C15H25N3/c1-3-11-16-12-13-7-6-10-15(17-13)18(2)14-8-4-5-9-14/h6-7,10,14,16H,3-5,8-9,11-12H2,1-2H3
InChIKeyRKABMLGRNRCYJR-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine?
The IUPAC name of N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine (CID 62278994) is N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine.
What is the SMILES notation for N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine?
The canonical SMILES for N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine is CCCNCc1cccc(N(C)C2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine?
The InChIKey is RKABMLGRNRCYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-11-16-12-13-7-6-10-15(17-13)18(2)14-8-4-5-9-14/h6-7,10,14,16H,3-5,8-9,11-12H2,1-2H3.
What are the key properties of N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine?
N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 62278994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).