N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide

C17H27N3O — CID 62830761

IUPACN-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(CCCN)C2CCCCC2)c(C)n1
InChIInChI=1S/C17H27N3O/c1-13-9-10-16(14(2)19-13)17(21)20(12-6-11-18)15-7-4-3-5-8-15/h9-10,15H,3-8,11-12,18H2,1-2H3
InChIKeyODVTXWQJUDHJOE-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.82
Rot. Bonds5

About N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide

N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide (PubChem CID 62830761) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide
PubChem CID62830761
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(CCCN)C2CCCCC2)c(C)n1
InChIInChI=1S/C17H27N3O/c1-13-9-10-16(14(2)19-13)17(21)20(12-6-11-18)15-7-4-3-5-8-15/h9-10,15H,3-8,11-12,18H2,1-2H3
InChIKeyODVTXWQJUDHJOE-UHFFFAOYSA-N
XLogP2.82
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2,6-dimethyl-N-prop-2-ynylpyridine-3-carboxamide
CID 75417781
N-cyclopropyl-N-(2-hydroxyethyl)-2,6-dimethylpyridine-3-carboxamide
CID 62830779
N-(3-aminopropyl)-N-cyclopentyl-2-methylbenzamide
CID 43319365
N-(3-aminopropyl)-N-cyclobutyl-2-methylbenzamide
CID 102873748
N-(3-aminopropyl)-N-cyclopentyl-1,3-dimethylpyrazole-4-carboxamide
CID 102801032
N-(3-aminopropyl)-N-cyclohexyl-2-fluoro-5-methylbenzamide
CID 62515468
N-(3-aminopropyl)-N-cyclohexyl-1,5-dimethylpyrazole-4-carboxamide
CID 43319374
N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285
N-(3-aminopropyl)-N-cyclohexyl-2,5-difluorobenzamide
CID 43319379
N-(3-aminopropyl)-N-cyclopentyl-3-ethyl-1-methylpyrazole-4-carboxamide
CID 102809889
N-(3-aminopropyl)-N-cyclopentyl-2-methoxy-5-methylbenzamide
CID 62504725
N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide
CID 43136887

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide (CID 62830761) is N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)N(CCCN)C2CCCCC2)c(C)n1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide?
The InChIKey is ODVTXWQJUDHJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-13-9-10-16(14(2)19-13)17(21)20(12-6-11-18)15-7-4-3-5-8-15/h9-10,15H,3-8,11-12,18H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide?
N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide has a molecular weight of 289.42 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclohexyl-2,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 62830761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).