N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide

C19H19N3O3 — CID 144891688

IUPACN-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccc3oc(=O)[nH]c3c2)cc1)C1CCCCN1
InChIInChI=1S/C19H19N3O3/c23-18(15-3-1-2-10-20-15)21-14-7-4-12(5-8-14)13-6-9-17-16(11-13)22-19(24)25-17/h4-9,11,15,20H,1-3,10H2,(H,21,23)(H,22,24)
InChIKeyVYHSXTYITZDZLQ-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.87
Rot. Bonds3

About N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide

N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide (PubChem CID 144891688) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide
PubChem CID144891688
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccc3oc(=O)[nH]c3c2)cc1)C1CCCCN1
InChIInChI=1S/C19H19N3O3/c23-18(15-3-1-2-10-20-15)21-14-7-4-12(5-8-14)13-6-9-17-16(11-13)22-19(24)25-17/h4-9,11,15,20H,1-3,10H2,(H,21,23)(H,22,24)
InChIKeyVYHSXTYITZDZLQ-UHFFFAOYSA-N
XLogP2.87
TPSA87.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-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

(2S)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)piperidine-2-carboxamide;hydrochloride
CID 119709884
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939
4-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclohexane-1-carboxamide
CID 60850506
(2S)-N-(4-bromophenyl)piperidine-2-carboxamide;hydrochloride
CID 119670350
(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
(2S)-N-[4-(2-methylpropanoylamino)phenyl]piperidine-2-carboxamide
CID 103808067
N-[4-(1,2,4-oxadiazol-3-yl)phenyl]piperidine-2-carboxamide
CID 119311035
2-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119709874
N-(4-aminophenyl)pyrrolidine-2-carboxamide
CID 22034800
(2S)-N-(4-acetamidophenyl)pyrrolidine-2-carboxamide
CID 22691413
N-[4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43709925
N-(4-pyrimidin-5-ylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119328472

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide?
The IUPAC name of N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide (CID 144891688) is N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide?
The canonical SMILES for N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide is O=C(Nc1ccc(-c2ccc3oc(=O)[nH]c3c2)cc1)C1CCCCN1.
What is the InChIKey of N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide?
The InChIKey is VYHSXTYITZDZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-18(15-3-1-2-10-20-15)21-14-7-4-12(5-8-14)13-6-9-17-16(11-13)22-19(24)25-17/h4-9,11,15,20H,1-3,10H2,(H,21,23)(H,22,24).
What are the key properties of N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide?
N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.87, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxo-3H-1,3-benzoxazol-5-yl)phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 144891688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).