N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide

C15H23N3O — CID 105068587

IUPACN-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCC1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-8-17-14-11-16-9-7-13(14)15(19)18-10-12-5-3-4-6-12/h7,9,11-12,17H,2-6,8,10H2,1H3,(H,18,19)
InChIKeyBFBQFJJGWRBIQL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.82
Rot. Bonds6

About N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide

N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105068587) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105068587
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCC1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-8-17-14-11-16-9-7-13(14)15(19)18-10-12-5-3-4-6-12/h7,9,11-12,17H,2-6,8,10H2,1H3,(H,18,19)
InChIKeyBFBQFJJGWRBIQL-UHFFFAOYSA-N
XLogP2.82
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(propylamino)-N-(thiolan-2-ylmethyl)pyridine-4-carboxamide
CID 105070782
N-(oxolan-2-ylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068089
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
N-(3-cyclopropylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071385
N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105070142
N-(cyclopentylmethyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236600
N-(3-butoxypropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071243
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071169
N-cyclobutyl-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071339
N-[(1-methylpiperidin-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81238615
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62168476

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide (CID 105068587) is N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is BFBQFJJGWRBIQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-8-17-14-11-16-9-7-13(14)15(19)18-10-12-5-3-4-6-12/h7,9,11-12,17H,2-6,8,10H2,1H3,(H,18,19).
What are the key properties of N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide?
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).