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

C16H25N3O — CID 105070142

IUPACN-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CC1CCCC1
InChIInChI=1S/C16H25N3O/c1-3-9-18-15-11-17-10-8-14(15)16(20)19(2)12-13-6-4-5-7-13/h8,10-11,13,18H,3-7,9,12H2,1-2H3
InChIKeyLFGIOGYQMQGURK-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.17
Rot. Bonds6

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

N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105070142) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
PubChem CID105070142
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CC1CCCC1
InChIInChI=1S/C16H25N3O/c1-3-9-18-15-11-17-10-8-14(15)16(20)19(2)12-13-6-4-5-7-13/h8,10-11,13,18H,3-7,9,12H2,1-2H3
InChIKeyLFGIOGYQMQGURK-UHFFFAOYSA-N
XLogP3.17
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068880
N-(cyclohexylmethyl)-N-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238812
N-cyclobutyl-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071339
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587
N-(cyclohexylmethyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 80707237
N-(3-hydroxybutyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071302
N-(2-cyanoethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068056
3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 105068980
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
N-(5-hydroxypentyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 107201068
N-methyl-3-(propylamino)-N-pyridin-4-ylpyridine-4-carboxamide
CID 106937266
3-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 105069188

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (CID 105070142) is N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)N(C)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is LFGIOGYQMQGURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-9-18-15-11-17-10-8-14(15)16(20)19(2)12-13-6-4-5-7-13/h8,10-11,13,18H,3-7,9,12H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105070142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).