3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide

C18H20FNO — CID 134049187

IUPAC3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide
SMILESCc1ccccc1CN(C)C(=O)CCc1ccc(F)cc1
InChIInChI=1S/C18H20FNO/c1-14-5-3-4-6-16(14)13-20(2)18(21)12-9-15-7-10-17(19)11-8-15/h3-8,10-11H,9,12-13H2,1-2H3
InChIKeyOSUIIIYRRASMPK-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.73
Rot. Bonds5

About 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide

3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide (PubChem CID 134049187) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide
PubChem CID134049187
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide
SMILESCc1ccccc1CN(C)C(=O)CCc1ccc(F)cc1
InChIInChI=1S/C18H20FNO/c1-14-5-3-4-6-16(14)13-20(2)18(21)12-9-15-7-10-17(19)11-8-15/h3-8,10-11H,9,12-13H2,1-2H3
InChIKeyOSUIIIYRRASMPK-UHFFFAOYSA-N
XLogP3.73
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[3-[methyl-[(2-methylphenyl)methyl]amino]-3-oxopropyl]benzoic acid
CID 119179454
3-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 94870765
2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 16769161
3-(2-bromophenyl)-N-[(4-fluorophenyl)methyl]-N-methylpropanamide
CID 55833951
3-chloro-N-methyl-N-[(2-methylphenyl)methyl]propanamide
CID 43578823
4-[[methyl-[3-(2-methylphenyl)propanoyl]amino]methyl]benzoic acid
CID 119225951
N-methyl-3-(4-methylphenyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide
CID 55550183
5-chloro-N-methyl-N-[(2-methylphenyl)methyl]pentanamide
CID 43578825
3-(4-fluorophenyl)-N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
CID 100548168
3-(3-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 78829784
3-[methyl-[(2-methylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231590
3-amino-N-[(4-fluorophenyl)methyl]-N-methylpropanamide
CID 39242618

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide (CID 134049187) is 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide is Cc1ccccc1CN(C)C(=O)CCc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide?
The InChIKey is OSUIIIYRRASMPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c1-14-5-3-4-6-16(14)13-20(2)18(21)12-9-15-7-10-17(19)11-8-15/h3-8,10-11H,9,12-13H2,1-2H3.
What are the key properties of 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide?
3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide has a molecular weight of 285.36 g/mol, XLogP of 3.73, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-methyl-N-[(2-methylphenyl)methyl]propanamide is sourced from PubChem (CID 134049187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).