N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide

C18H17FN2O2 — CID 38324619

IUPACN-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide
SMILESO=C(Cc1cccc(F)c1)Nc1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C18H17FN2O2/c19-14-4-1-3-12(9-14)10-17(22)20-15-5-2-6-16(11-15)21-18(23)13-7-8-13/h1-6,9,11,13H,7-8,10H2,(H,20,22)(H,21,23)
InChIKeyCWDKPQOJUWOTDM-UHFFFAOYSA-N
MW312.34 g/mol
LogP3.36
Rot. Bonds5

About N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide

N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide (PubChem CID 38324619) has the molecular formula C18H17FN2O2 and a molecular weight of 312.34 g/mol. Its IUPAC name is N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide
PubChem CID38324619
Molecular FormulaC18H17FN2O2
Molecular Weight312.34 g/mol
Exact Mass312.13
IUPAC NameN-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide
SMILESO=C(Cc1cccc(F)c1)Nc1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C18H17FN2O2/c19-14-4-1-3-12(9-14)10-17(22)20-15-5-2-6-16(11-15)21-18(23)13-7-8-13/h1-6,9,11,13H,7-8,10H2,(H,20,22)(H,21,23)
InChIKeyCWDKPQOJUWOTDM-UHFFFAOYSA-N
XLogP3.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[[2-[[2-(3-fluorophenyl)acetyl]amino]acetyl]amino]phenyl]cyclopropanecarboxamide
CID 55828959
N-[3-(cyclopropanecarbonylamino)phenyl]-1-[(3-fluorophenyl)methyl]piperidine-3-carboxamide
CID 47805198
N-[3-[(2-aminoacetyl)amino]phenyl]cyclopropanecarboxamide
CID 61251263
1-N-(4-acetamidophenyl)-4-N-(3-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109151103
4-N-(3-fluorophenyl)-1-N-[(3-methylphenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148115
N-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]cyclopropanecarboxamide
CID 46570342
4-fluoro-N-[3-[(4-fluorocyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 171577056
N-[3-(butanoylamino)phenyl]cyclopropanecarboxamide
CID 17187554
4-N-(3-fluorophenyl)-1-N-[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148399
N-[3-(chloromethyl)phenyl]cyclopropanecarboxamide
CID 114293194
4-N-(3-fluorophenyl)-1-N-prop-2-enylcyclohexane-1,4-dicarboxamide
CID 109145001
1-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134379

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide (CID 38324619) is N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide is O=C(Cc1cccc(F)c1)Nc1cccc(NC(=O)C2CC2)c1.
What is the InChIKey of N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide?
The InChIKey is CWDKPQOJUWOTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2/c19-14-4-1-3-12(9-14)10-17(22)20-15-5-2-6-16(11-15)21-18(23)13-7-8-13/h1-6,9,11,13H,7-8,10H2,(H,20,22)(H,21,23).
What are the key properties of N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide?
N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide has a molecular weight of 312.34 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(3-fluorophenyl)acetyl]amino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 38324619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).