N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine

C15H25N3 — CID 63655101

IUPACN-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
SMILESCCNCc1cc(N(C)CC2CCCC2)ccn1
InChIInChI=1S/C15H25N3/c1-3-16-11-14-10-15(8-9-17-14)18(2)12-13-6-4-5-7-13/h8-10,13,16H,3-7,11-12H2,1-2H3
InChIKeyJDCMKPCGMSKFQR-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.82
Rot. Bonds6

About N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine

N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine (PubChem CID 63655101) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
PubChem CID63655101
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine
SMILESCCNCc1cc(N(C)CC2CCCC2)ccn1
InChIInChI=1S/C15H25N3/c1-3-16-11-14-10-15(8-9-17-14)18(2)12-13-6-4-5-7-13/h8-10,13,16H,3-7,11-12H2,1-2H3
InChIKeyJDCMKPCGMSKFQR-UHFFFAOYSA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The IUPAC name of N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine (CID 63655101) is N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The canonical SMILES for N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine is CCNCc1cc(N(C)CC2CCCC2)ccn1.
What is the InChIKey of N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
The InChIKey is JDCMKPCGMSKFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-16-11-14-10-15(8-9-17-14)18(2)12-13-6-4-5-7-13/h8-10,13,16H,3-7,11-12H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine?
N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-(ethylaminomethyl)-N-methylpyridin-4-amine is sourced from PubChem (CID 63655101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).