N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide

C19H19FN2O2 — CID 41266031

IUPACN-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide
SMILESO=C(CCc1ccccc1F)Nc1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C19H19FN2O2/c20-17-4-2-1-3-13(17)7-12-18(23)21-15-8-10-16(11-9-15)22-19(24)14-5-6-14/h1-4,8-11,14H,5-7,12H2,(H,21,23)(H,22,24)
InChIKeyHJLVCBHSQIHZCP-UHFFFAOYSA-N
MW326.37 g/mol
LogP3.75
Rot. Bonds6

About N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide

N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide (PubChem CID 41266031) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide
PubChem CID41266031
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC NameN-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide
SMILESO=C(CCc1ccccc1F)Nc1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C19H19FN2O2/c20-17-4-2-1-3-13(17)7-12-18(23)21-15-8-10-16(11-9-15)22-19(24)14-5-6-14/h1-4,8-11,14H,5-7,12H2,(H,21,23)(H,22,24)
InChIKeyHJLVCBHSQIHZCP-UHFFFAOYSA-N
XLogP3.75
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-fluorophenyl)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 26716432
N-[4-[2-(2-fluorophenyl)ethylamino]phenyl]oxane-4-carboxamide
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4-N-(4-chlorophenyl)-1-N-[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148389
3-(2-fluorophenyl)-N-[4-(3-methylpyrrolidin-1-yl)phenyl]propanamide
CID 56556359
N-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoylamino]phenyl]cyclopropanecarboxamide
CID 26059317
3-(2-fluorophenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 38196539
1-cyclopropyl-3-(2-fluorophenyl)propan-1-one
CID 63351757
N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-3-(2-fluorophenyl)propanamide
CID 35343898
3-(2-fluorophenyl)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]propanamide
CID 9428151
3-(2-fluorophenyl)-N-[4-(phenylsulfanylmethyl)phenyl]propanamide
CID 100714513
N-[4-[[3-(2-chlorophenyl)propanoylamino]carbamoyl]phenyl]cyclopropanecarboxamide
CID 17179166
4-N-(4-cyanophenyl)-1-N-[(2-fluorophenyl)methyl]cyclohexane-1,4-dicarboxamide
CID 109148405

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide (CID 41266031) is N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide is O=C(CCc1ccccc1F)Nc1ccc(NC(=O)C2CC2)cc1.
What is the InChIKey of N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide?
The InChIKey is HJLVCBHSQIHZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c20-17-4-2-1-3-13(17)7-12-18(23)21-15-8-10-16(11-9-15)22-19(24)14-5-6-14/h1-4,8-11,14H,5-7,12H2,(H,21,23)(H,22,24).
What are the key properties of N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide?
N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide has a molecular weight of 326.37 g/mol, XLogP of 3.75, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 41266031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).