N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide

C14H21N3O — CID 79115334

IUPACN-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1)C1CCC(N)CC1
InChIInChI=1S/C14H21N3O/c1-2-17(13-5-3-12(15)4-6-13)14(18)11-7-9-16-10-8-11/h7-10,12-13H,2-6,15H2,1H3
InChIKeyTZDYSWWQOMHGOY-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.81
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide

N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide (PubChem CID 79115334) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide
PubChem CID79115334
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide
SMILESCCN(C(=O)c1ccncc1)C1CCC(N)CC1
InChIInChI=1S/C14H21N3O/c1-2-17(13-5-3-12(15)4-6-13)14(18)11-7-9-16-10-8-11/h7-10,12-13H,2-6,15H2,1H3
InChIKeyTZDYSWWQOMHGOY-UHFFFAOYSA-N
XLogP1.81
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-N-ethylbenzamide
CID 79116189
N-(4-aminocyclohexyl)-N-ethyl-4-methoxybenzamide
CID 79115419
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethylpyridine-4-carboxamide
CID 61230749
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-3-carboxamide
CID 104786244
N-(4-aminocyclohexyl)-5-chloro-N-ethylpyridine-2-carboxamide
CID 79115416
4-N-cyclopropyl-4-N-ethylbenzene-1,4-dicarboxamide
CID 47155368
N-(4-aminocyclohexyl)-N-ethyl-3-hydroxypyridine-2-carboxamide
CID 79115604
N-(4-aminocyclohexyl)-N-ethyl-5-methylpyrazine-2-carboxamide
CID 79115750
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
CID 104639321
N-(4-aminocyclohexyl)-N-ethyl-3H-benzimidazole-5-carboxamide
CID 79114771
3-amino-N-cyclopropyl-N-ethylpyridine-4-carboxamide
CID 105068531
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide (CID 79115334) is N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide is CCN(C(=O)c1ccncc1)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide?
The InChIKey is TZDYSWWQOMHGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-17(13-5-3-12(15)4-6-13)14(18)11-7-9-16-10-8-11/h7-10,12-13H,2-6,15H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide?
N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-ethylpyridine-4-carboxamide is sourced from PubChem (CID 79115334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).