N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide

C13H15N3O3 — CID 110837964

IUPACN-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)C1CCNCC1
InChIInChI=1S/C13H15N3O3/c17-12(8-3-5-14-6-4-8)15-9-1-2-10-11(7-9)19-13(18)16-10/h1-2,7-8,14H,3-6H2,(H,15,17)(H,16,18)
InChIKeyLKXZHZWTUCFEHS-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.06
Rot. Bonds2

About N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide

N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide (PubChem CID 110837964) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide
PubChem CID110837964
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC NameN-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc2[nH]c(=O)oc2c1)C1CCNCC1
InChIInChI=1S/C13H15N3O3/c17-12(8-3-5-14-6-4-8)15-9-1-2-10-11(7-9)19-13(18)16-10/h1-2,7-8,14H,3-6H2,(H,15,17)(H,16,18)
InChIKeyLKXZHZWTUCFEHS-UHFFFAOYSA-N
XLogP1.06
TPSA87.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-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

tert-butyl 4-[(2-oxo-3H-1,3-benzoxazol-6-yl)carbamoyl]piperidine-1-carboxylate
CID 110608133
4-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclohexane-1-carboxamide
CID 60850506
2-hydroxy-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
CID 83820376
2-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)propanamide
CID 115175381
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-2-sulfanylacetamide
CID 115166967
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)piperidine-4-carboxamide;hydrochloride
CID 119312603
1-(3,4-dimethoxyphenyl)-5-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)pyrrolidine-3-carboxamide
CID 110608206
N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3-(pyrrolidin-3-ylmethyl)benzamide;hydrochloride
CID 171708243
3-chloro-N-(2-oxo-3H-1,3-benzoxazol-6-yl)propanamide
CID 11543243
1-(3,4-dichlorophenyl)-3-(2-oxo-3H-1,3-benzoxazol-6-yl)urea
CID 155113953
1-(2,2-difluorocycloheptyl)-3-(2-oxo-3H-1,3-benzoxazol-6-yl)urea
CID 167962154
ethyl 2-oxo-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)amino]acetate
CID 53304199

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide?
The IUPAC name of N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide (CID 110837964) is N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide is O=C(Nc1ccc2[nH]c(=O)oc2c1)C1CCNCC1.
What is the InChIKey of N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide?
The InChIKey is LKXZHZWTUCFEHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c17-12(8-3-5-14-6-4-8)15-9-1-2-10-11(7-9)19-13(18)16-10/h1-2,7-8,14H,3-6H2,(H,15,17)(H,16,18).
What are the key properties of N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide?
N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide has a molecular weight of 261.28 g/mol, XLogP of 1.06, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-3H-1,3-benzoxazol-6-yl)piperidine-4-carboxamide is sourced from PubChem (CID 110837964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).