4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide

C15H21N3O2 — CID 175815050

IUPAC4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide
SMILESNC(=O)c1cc(NC(=O)CCC2CCCCC2)ccn1
InChIInChI=1S/C15H21N3O2/c16-15(20)13-10-12(8-9-17-13)18-14(19)7-6-11-4-2-1-3-5-11/h8-11H,1-7H2,(H2,16,20)(H,17,18,19)
InChIKeyDLFUFVAKOAALJS-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.48
Rot. Bonds5

About 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide

4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide (PubChem CID 175815050) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide
PubChem CID175815050
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide
SMILESNC(=O)c1cc(NC(=O)CCC2CCCCC2)ccn1
InChIInChI=1S/C15H21N3O2/c16-15(20)13-10-12(8-9-17-13)18-14(19)7-6-11-4-2-1-3-5-11/h8-11H,1-7H2,(H2,16,20)(H,17,18,19)
InChIKeyDLFUFVAKOAALJS-UHFFFAOYSA-N
XLogP2.48
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide
CID 136527343
N-(3-amino-4-bromophenyl)-3-cyclohexylpropanamide
CID 79767583
N-[4-(3-aminoprop-1-ynyl)-2-pyridinyl]-3-cyclohexylpropanamide
CID 102821250
3-cyclohexyl-N-[4-(3-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]propanamide
CID 16873246
3-cyclohexyl-N-[3-(propanoylamino)phenyl]propanamide
CID 46568170
N-(3-chlorophenyl)-3-cyclohexylpropanamide
CID 803651
N-(6-chloro-3-pyridinyl)-3-cyclohexylpropanamide
CID 113231839
3-cyclohexyl-N-(3-sulfamoylphenyl)propanamide
CID 4588833
3-cyclohexyl-N-(4-sulfanylphenyl)propanamide
CID 27125888
N-(2-methyl-4-pyridinyl)-3-piperidin-3-ylpropanamide
CID 79241024
N-[3-(3-cyclohexylpropanoylamino)phenyl]-1,3-thiazole-2-carboxamide
CID 17362343
3-cyclohexyl-N-(2-piperidin-1-ylpyrimidin-5-yl)propanamide
CID 122298424

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide?
The IUPAC name of 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide (CID 175815050) is 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide?
The canonical SMILES for 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide is NC(=O)c1cc(NC(=O)CCC2CCCCC2)ccn1.
What is the InChIKey of 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide?
The InChIKey is DLFUFVAKOAALJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c16-15(20)13-10-12(8-9-17-13)18-14(19)7-6-11-4-2-1-3-5-11/h8-11H,1-7H2,(H2,16,20)(H,17,18,19).
What are the key properties of 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide?
4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclohexylpropanoylamino)pyridine-2-carboxamide is sourced from PubChem (CID 175815050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).