N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide

C24H21FN2O3 — CID 46553769

IUPACN-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
SMILESO=C(Nc1ccc(C(=O)NC2CC2)cc1)c1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C24H21FN2O3/c25-19-8-4-16(5-9-19)15-30-22-3-1-2-18(14-22)24(29)27-20-10-6-17(7-11-20)23(28)26-21-12-13-21/h1-11,14,21H,12-13,15H2,(H,26,28)(H,27,29)
InChIKeyUMBJKWJQFWYZMX-UHFFFAOYSA-N
MW404.44 g/mol
LogP4.55
Rot. Bonds7

About N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide

N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide (PubChem CID 46553769) has the molecular formula C24H21FN2O3 and a molecular weight of 404.44 g/mol. Its IUPAC name is N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound NameN-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
PubChem CID46553769
Molecular FormulaC24H21FN2O3
Molecular Weight404.44 g/mol
Exact Mass404.15
IUPAC NameN-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
SMILESO=C(Nc1ccc(C(=O)NC2CC2)cc1)c1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C24H21FN2O3/c25-19-8-4-16(5-9-19)15-30-22-3-1-2-18(14-22)24(29)27-20-10-6-17(7-11-20)23(28)26-21-12-13-21/h1-11,14,21H,12-13,15H2,(H,26,28)(H,27,29)
InChIKeyUMBJKWJQFWYZMX-UHFFFAOYSA-N
XLogP4.55
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.44
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-amino-2-oxoethyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 31857522
N-[(3S)-1,1-dioxothiolan-3-yl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 51925377
1-N-cyclopropyl-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109043370
ethyl 4-[[3-[(4-fluorophenyl)methoxy]benzoyl]amino]piperidine-1-carboxylate
CID 32964503
N-(4-hydroxycyclohexyl)-3-phenylmethoxybenzamide
CID 17447563
3-[[4-[(4-fluorophenyl)methoxy]benzoyl]amino]benzoic acid
CID 139501079
3-cyano-N-[3-[(4-fluorophenyl)methoxy]phenyl]benzamide
CID 46594970
N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 30697494
N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 18287359
N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide
CID 43041597
2-[3-[(4-fluorophenyl)carbamoyl]phenoxy]acetic acid
CID 28762936
N-[4-(cyclopropylcarbamoyl)phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 46584687

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide?
The IUPAC name of N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide (CID 46553769) is N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide?
The canonical SMILES for N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide is O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1cccc(OCc2ccc(F)cc2)c1.
What is the InChIKey of N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide?
The InChIKey is UMBJKWJQFWYZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN2O3/c25-19-8-4-16(5-9-19)15-30-22-3-1-2-18(14-22)24(29)27-20-10-6-17(7-11-20)23(28)26-21-12-13-21/h1-11,14,21H,12-13,15H2,(H,26,28)(H,27,29).
What are the key properties of N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide?
N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide has a molecular weight of 404.44 g/mol, XLogP of 4.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 46553769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).