4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide

C14H21N3O — CID 43517479

IUPAC4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NCC2CCCC2)ccn1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)13-9-12(7-8-15-13)16-10-11-5-3-4-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,15,16)
InChIKeyNNEAOUQYZSQMJS-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.39
Rot. Bonds4

About 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide

4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide (PubChem CID 43517479) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
PubChem CID43517479
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NCC2CCCC2)ccn1
InChIInChI=1S/C14H21N3O/c1-17(2)14(18)13-9-12(7-8-15-13)16-10-11-5-3-4-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,15,16)
InChIKeyNNEAOUQYZSQMJS-UHFFFAOYSA-N
XLogP2.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-hydroxycyclohexyl)methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 103703448
4-[(1,1-dioxothiolan-2-yl)methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 81040809
4-[(1-ethylpyrrolidin-3-yl)methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 60855023
4-(2-cyclopropylpropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 115620851
N,N-diethyl-4-(oxan-3-ylmethylamino)pyridine-2-carboxamide
CID 61019704
N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
CID 62167949
4-[(2-amino-2-methylpropyl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 113282785
N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 103989633
N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide
CID 55047491
N,N-dimethyl-4-[[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxamide
CID 43395819
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide (CID 43517479) is 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide is CN(C)C(=O)c1cc(NCC2CCCC2)ccn1.
What is the InChIKey of 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is NNEAOUQYZSQMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(2)14(18)13-9-12(7-8-15-13)16-10-11-5-3-4-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,15,16).
What are the key properties of 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide?
4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 43517479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).