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

C14H21N3O — CID 105068880

IUPACN-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CC1CC1
InChIInChI=1S/C14H21N3O/c1-3-7-16-13-9-15-8-6-12(13)14(18)17(2)10-11-4-5-11/h6,8-9,11,16H,3-5,7,10H2,1-2H3
InChIKeyXADPIFCYYULTIZ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.39
Rot. Bonds6

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

N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105068880) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
PubChem CID105068880
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CC1CC1
InChIInChI=1S/C14H21N3O/c1-3-7-16-13-9-15-8-6-12(13)14(18)17(2)10-11-4-5-11/h6,8-9,11,16H,3-5,7,10H2,1-2H3
InChIKeyXADPIFCYYULTIZ-UHFFFAOYSA-N
XLogP2.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105070142
N-(cyclohexylmethyl)-N-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238812
N-cyclobutyl-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071339
N-(3-hydroxybutyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071302
N-(2-cyanoethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068056
N-(3-cyclopropylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071385
N-(5-hydroxypentyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 107201068
N-methyl-3-(propylamino)-N-pyridin-4-ylpyridine-4-carboxamide
CID 106937266
N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
CID 62509873
N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105069961
N-(2-cyanoethyl)-N-cyclopropyl-3-(propylamino)pyridine-4-carboxamide
CID 105069192
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (CID 105068880) is N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)N(C)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is XADPIFCYYULTIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-7-16-13-9-15-8-6-12(13)14(18)17(2)10-11-4-5-11/h6,8-9,11,16H,3-5,7,10H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).