N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide

C14H18FNO — CID 42266064

IUPACN-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H18FNO/c1-10(2)13(17)16-9-14(7-8-14)11-3-5-12(15)6-4-11/h3-6,10H,7-9H2,1-2H3,(H,16,17)
InChIKeyONGWHZMGQMGGKG-UHFFFAOYSA-N
MW235.30 g/mol
LogP2.63
Rot. Bonds4

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

N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide (PubChem CID 42266064) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
PubChem CID42266064
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC NameN-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H18FNO/c1-10(2)13(17)16-9-14(7-8-14)11-3-5-12(15)6-4-11/h3-6,10H,7-9H2,1-2H3,(H,16,17)
InChIKeyONGWHZMGQMGGKG-UHFFFAOYSA-N
XLogP2.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]propanamide
CID 119293598
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methyl-3-(methylamino)propanamide
CID 119731221
(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-methylpentanamide
CID 110482473
2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide
CID 119293600
3-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]butanamide
CID 119731231
1-butan-2-yl-3-[[1-(4-fluorophenyl)cyclopropyl]methyl]urea
CID 113214285
1-[[1-(4-fluorophenyl)cyclopropyl]methyl]-3-(3-hydroxybutyl)urea
CID 111337214
(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-methylsulfanylbutanamide
CID 119293591
N-[[1-(4-methoxyphenyl)cyclobutyl]methyl]-2-methylpropanamide
CID 110478485
tert-butyl N-[1-[[1-(4-fluorophenyl)cyclopropyl]methylamino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 78902805
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119731211
(E)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]but-2-enamide
CID 110477965

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The IUPAC name of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide (CID 42266064) is N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide.
What is the SMILES notation for N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The canonical SMILES for N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide is CC(C)C(=O)NCC1(c2ccc(F)cc2)CC1.
What is the InChIKey of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The InChIKey is ONGWHZMGQMGGKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-10(2)13(17)16-9-14(7-8-14)11-3-5-12(15)6-4-11/h3-6,10H,7-9H2,1-2H3,(H,16,17).
What are the key properties of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide has a molecular weight of 235.30 g/mol, XLogP of 2.63, 4 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]methyl]-2-methylpropanamide is sourced from PubChem (CID 42266064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).