N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide

C17H20N4O3 — CID 72717053

IUPACN-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1nc(C(=O)NC2CCCCCC2)co1)c1ccncc1
InChIInChI=1S/C17H20N4O3/c22-15(12-7-9-18-10-8-12)21-17-20-14(11-24-17)16(23)19-13-5-3-1-2-4-6-13/h7-11,13H,1-6H2,(H,19,23)(H,20,21,22)
InChIKeySFKYJMAKMZTOET-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.77
Rot. Bonds4

About N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide

N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide (PubChem CID 72717053) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide
PubChem CID72717053
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1nc(C(=O)NC2CCCCCC2)co1)c1ccncc1
InChIInChI=1S/C17H20N4O3/c22-15(12-7-9-18-10-8-12)21-17-20-14(11-24-17)16(23)19-13-5-3-1-2-4-6-13/h7-11,13H,1-6H2,(H,19,23)(H,20,21,22)
InChIKeySFKYJMAKMZTOET-UHFFFAOYSA-N
XLogP2.77
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 90514925
2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxylic acid
CID 91669614
N-cyclohexylpyridine-4-carboxamide
CID 3436730
N-cyclopentylpyridine-4-carboxamide
CID 4212000
2-amino-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 110848950
[4-(cyclopropylcarbamoyl)-1,3-oxazol-2-yl]carbamic acid
CID 138692159
N-cyclododecyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole-4-carboxamide
CID 84557279
2-benzamido-N-(2-pyridin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 90515066
2-N-cyclohexyl-4-N-(2,6-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081638
N-cyclohexyl-4-(2-pyridin-4-ylethyl)benzamide
CID 67802758
N-[2-(cyclohexylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 47172514
N-cycloheptyl-2-(pyridin-4-ylmethylamino)pyrimidine-4-carboxamide
CID 109307486

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide (CID 72717053) is N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide is O=C(Nc1nc(C(=O)NC2CCCCCC2)co1)c1ccncc1.
What is the InChIKey of N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide?
The InChIKey is SFKYJMAKMZTOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c22-15(12-7-9-18-10-8-12)21-17-20-14(11-24-17)16(23)19-13-5-3-1-2-4-6-13/h7-11,13H,1-6H2,(H,19,23)(H,20,21,22).
What are the key properties of N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide?
N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 72717053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).