N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide

C23H20N2O3 — CID 25276057

IUPACN-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C23H20N2O3/c26-22(16-9-10-16)24-18-11-13-19(14-12-18)25-23(27)17-5-4-8-21(15-17)28-20-6-2-1-3-7-20/h1-8,11-16H,9-10H2,(H,24,26)(H,25,27)
InChIKeyXOOHTPFNFLGDGF-UHFFFAOYSA-N
MW372.42 g/mol
LogP5.08
Rot. Bonds6

About N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide

N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide (PubChem CID 25276057) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide.

Molecular Properties

Compound NameN-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide
PubChem CID25276057
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC NameN-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C23H20N2O3/c26-22(16-9-10-16)24-18-11-13-19(14-12-18)25-23(27)17-5-4-8-21(15-17)28-20-6-2-1-3-7-20/h1-8,11-16H,9-10H2,(H,24,26)(H,25,27)
InChIKeyXOOHTPFNFLGDGF-UHFFFAOYSA-N
XLogP5.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.42
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropanecarbonylamino)-N-(4-phenoxyphenyl)benzamide
CID 34757379
N-(4-acetamidophenyl)-3-phenoxybenzamide
CID 2483771
1-N,3-N-bis(4-phenoxyphenyl)benzene-1,3-dicarboxamide
CID 3090014
N-(4-bromophenyl)-3-phenoxybenzamide
CID 1318843
N-(4-phenoxyphenyl)-3-phenylbenzamide
CID 117089120
N-[4-(azepan-1-yl)phenyl]-3-phenoxybenzamide
CID 7582084
N-cyclopropyl-3-[(3-phenoxybenzoyl)amino]benzamide
CID 9438583
[3-[[3-(cyclopropanecarbonylamino)phenyl]carbamoyl]phenyl] acetate
CID 108927861
N-(4-phenoxyphenyl)-3-propan-2-yloxybenzamide
CID 8779117
N-[4-(carbamoylamino)phenyl]-3-(cyclopropanecarbonylamino)benzamide
CID 33151643
[2-oxo-2-(4-phenoxyanilino)ethyl] 3-(cyclopropanecarbonylamino)benzoate
CID 32959940
N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
CID 46585132

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide?
The IUPAC name of N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide (CID 25276057) is N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide.
What is the SMILES notation for N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide?
The canonical SMILES for N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide is O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide?
The InChIKey is XOOHTPFNFLGDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-22(16-9-10-16)24-18-11-13-19(14-12-18)25-23(27)17-5-4-8-21(15-17)28-20-6-2-1-3-7-20/h1-8,11-16H,9-10H2,(H,24,26)(H,25,27).
What are the key properties of N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide?
N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide has a molecular weight of 372.42 g/mol, XLogP of 5.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropanecarbonylamino)phenyl]-3-phenoxybenzamide is sourced from PubChem (CID 25276057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).