4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide

C20H18N2O2 — CID 16942332

IUPAC4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide
SMILESO=C(Nc1onc2c1CCC2)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C20H18N2O2/c23-19(21-20-17-7-4-8-18(17)22-24-20)16-11-9-15(10-12-16)13-14-5-2-1-3-6-14/h1-3,5-6,9-12H,4,7-8,13H2,(H,21,23)
InChIKeyTZCNOQDOECIEDS-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.01
Rot. Bonds4

About 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide

4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide (PubChem CID 16942332) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide.

Molecular Properties

Compound Name4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide
PubChem CID16942332
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide
SMILESO=C(Nc1onc2c1CCC2)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C20H18N2O2/c23-19(21-20-17-7-4-8-18(17)22-24-20)16-11-9-15(10-12-16)13-14-5-2-1-3-6-14/h1-3,5-6,9-12H,4,7-8,13H2,(H,21,23)
InChIKeyTZCNOQDOECIEDS-UHFFFAOYSA-N
XLogP4.01
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide
CID 16942268
4-benzoyl-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide
CID 16942451
4-phenoxy-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide
CID 16942503
3-(benzenesulfonyl)-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)propanamide
CID 16942364
2,5-dichloro-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)benzamide
CID 16942469
N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)-2-oxochromene-3-carboxamide
CID 16942311
N-[(5S)-5-methyl-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl]benzamide
CID 41062815
N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)-4-(2-ethylpiperidin-1-yl)sulfonylbenzamide
CID 16942353
methyl 2-[(4-benzylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
CID 4618224
N-[(5S)-5-methyl-4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl]-2-phenylacetamide
CID 35343063
(2R)-2-(2-fluorophenoxy)-N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)butanamide
CID 42280140
phenyl(5,6,7,8-tetrahydro-4H-cyclohepta[c][1,2]oxazol-3-yl)methanone
CID 134984735

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide?
The IUPAC name of 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide (CID 16942332) is 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide.
What is the SMILES notation for 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide?
The canonical SMILES for 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide is O=C(Nc1onc2c1CCC2)c1ccc(Cc2ccccc2)cc1.
What is the InChIKey of 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide?
The InChIKey is TZCNOQDOECIEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c23-19(21-20-17-7-4-8-18(17)22-24-20)16-11-9-15(10-12-16)13-14-5-2-1-3-6-14/h1-3,5-6,9-12H,4,7-8,13H2,(H,21,23).
What are the key properties of 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide?
4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide has a molecular weight of 318.38 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-(5,6-dihydro-4H-cyclopenta[c][1,2]oxazol-3-yl)benzamide is sourced from PubChem (CID 16942332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).