1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide

C19H22N2O3 — CID 164638374

IUPAC1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide
SMILESO=C(Nc1ccc(-c2ncco2)cc1)C1([C@@H]2CCCCO2)CCC1
InChIInChI=1S/C19H22N2O3/c22-18(19(9-3-10-19)16-4-1-2-12-23-16)21-15-7-5-14(6-8-15)17-20-11-13-24-17/h5-8,11,13,16H,1-4,9-10,12H2,(H,21,22)/t16-/m0/s1
InChIKeyKXIMIIRXISLSMD-INIZCTEOSA-N
MW326.40 g/mol
LogP4.02
Rot. Bonds4

About 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide

1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide (PubChem CID 164638374) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide
PubChem CID164638374
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide
SMILESO=C(Nc1ccc(-c2ncco2)cc1)C1([C@@H]2CCCCO2)CCC1
InChIInChI=1S/C19H22N2O3/c22-18(19(9-3-10-19)16-4-1-2-12-23-16)21-15-7-5-14(6-8-15)17-20-11-13-24-17/h5-8,11,13,16H,1-4,9-10,12H2,(H,21,22)/t16-/m0/s1
InChIKeyKXIMIIRXISLSMD-INIZCTEOSA-N
XLogP4.02
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-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

4-(5-Phenyl-1,3-oxazol-2-yl)aniline
CID 854968
7-(4-Aminophenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]heptan-1-one
CID 16735384
N-[4-(5-oxazolyl)phenyl]benzamide
CID 2739167
2,4-difluoro-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 2739169
1-(5-(4-Aminophenyl)oxazol-2-yl)-7-phenylheptan-1-one
CID 16110703
N1-[4-(1,3-oxazol-5-yl)phenyl]-2,2-dimethylpropanamide
CID 2806322
4-(1,3-Oxazol-2-yl)aniline
CID 12371739
4-{[4-(2-Phenyl-1,3-oxazol-5-yl)phenyl]amino}-3-penten-2-one
CID 5310855
N'-tert-butyl-N-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]oxamide
CID 44291528
Methyl 6-[2-(7-phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-3-carboximidate
CID 76332657
(2R)-2-amino-4-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 104902976
N-[4-(1,3-oxazol-5-yl)phenyl]cyclopropanecarboxamide
CID 2806321

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide (CID 164638374) is 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide is O=C(Nc1ccc(-c2ncco2)cc1)C1([C@@H]2CCCCO2)CCC1.
What is the InChIKey of 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide?
The InChIKey is KXIMIIRXISLSMD-INIZCTEOSA-N. The full InChI is InChI=1S/C19H22N2O3/c22-18(19(9-3-10-19)16-4-1-2-12-23-16)21-15-7-5-14(6-8-15)17-20-11-13-24-17/h5-8,11,13,16H,1-4,9-10,12H2,(H,21,22)/t16-/m0/s1.
What are the key properties of 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide?
1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-oxan-2-yl]-N-[4-(1,3-oxazol-2-yl)phenyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 164638374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).