N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide

C17H16FNO — CID 110483009

IUPACN-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C17H16FNO/c1-12-4-2-3-5-15(12)16(20)19-17(10-11-17)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,20)
InChIKeySFEGGJDOEFOSFW-UHFFFAOYSA-N
MW269.32 g/mol
LogP3.55
Rot. Bonds3

About N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide

N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide (PubChem CID 110483009) has the molecular formula C17H16FNO and a molecular weight of 269.32 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide
PubChem CID110483009
Molecular FormulaC17H16FNO
Molecular Weight269.32 g/mol
Exact Mass269.12
IUPAC NameN-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C17H16FNO/c1-12-4-2-3-5-15(12)16(20)19-17(10-11-17)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,20)
InChIKeySFEGGJDOEFOSFW-UHFFFAOYSA-N
XLogP3.55
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(4-chlorophenyl)cyclopropyl]-2-methylbenzamide
CID 113091060
2-amino-N-[1-(4-fluorophenyl)cyclopropyl]benzamide
CID 110465658
N-[1-(4-fluorophenyl)cyclopropyl]-3,4-dimethylbenzamide
CID 113091009
2-hydroxy-N-(1-phenylcyclopropyl)benzamide
CID 110485071
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]-2-methylbenzamide
CID 27449958
N-[1-(4-fluorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110440290
N-[1-(4-fluorophenyl)cyclopentyl]-2-methoxypyridine-3-carboxamide
CID 60589118
N-[1-(4-fluorophenyl)cyclobutyl]-3-methylbenzamide
CID 110441487
N-[1-(4-fluorophenyl)cyclopropyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 110484321
N-[1-(4-fluorophenyl)cyclopropyl]-2,2-dimethylpropanamide
CID 110444694
N-[1-(4-fluorophenyl)cyclopropyl]-3-methylbutanamide
CID 71684215
N-[1-(4-fluorophenyl)cyclopentyl]acetamide
CID 71936960

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide (CID 110483009) is N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide is Cc1ccccc1C(=O)NC1(c2ccc(F)cc2)CC1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide?
The InChIKey is SFEGGJDOEFOSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO/c1-12-4-2-3-5-15(12)16(20)19-17(10-11-17)13-6-8-14(18)9-7-13/h2-9H,10-11H2,1H3,(H,19,20).
What are the key properties of N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide?
N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide has a molecular weight of 269.32 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)cyclopropyl]-2-methylbenzamide is sourced from PubChem (CID 110483009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).