1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one

C18H20FNO — CID 62036369

IUPAC1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one
SMILESCc1ccccc1CN(C)CC(=O)Cc1ccccc1F
InChIInChI=1S/C18H20FNO/c1-14-7-3-4-9-16(14)12-20(2)13-17(21)11-15-8-5-6-10-18(15)19/h3-10H,11-13H2,1-2H3
InChIKeySECKOORAADZOQC-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.38
Rot. Bonds6

About 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one

1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one (PubChem CID 62036369) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one
PubChem CID62036369
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one
SMILESCc1ccccc1CN(C)CC(=O)Cc1ccccc1F
InChIInChI=1S/C18H20FNO/c1-14-7-3-4-9-16(14)12-20(2)13-17(21)11-15-8-5-6-10-18(15)19/h3-10H,11-13H2,1-2H3
InChIKeySECKOORAADZOQC-UHFFFAOYSA-N
XLogP3.38
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[benzyl(methyl)amino]-3-(2-fluorophenyl)propan-2-one
CID 62051935
1-(2-fluorophenyl)-3-[methyl(pyridin-3-ylmethyl)amino]propan-2-one
CID 62052978
1-(2-fluorophenyl)-3-[methyl(pentyl)amino]propan-2-one
CID 43796057
ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 142212202
N-ethyl-2-[[3-(2-fluorophenyl)-2-oxopropyl]-methylamino]acetamide
CID 62036688
N-(3,4-difluorophenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 8964034
N-cyclopropyl-2-[[3-(2-fluorophenyl)-2-oxopropyl]-methylamino]acetamide
CID 62035342
1-(2,4-dichlorophenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanone
CID 60650610
N-(2-ethyl-6-methylphenyl)-2-[(2-fluorophenyl)methyl-methylamino]acetamide;oxalic acid
CID 15945235
1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone
CID 60650512
N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 78791355
1-(2-fluorophenyl)-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]propan-2-one
CID 63236723

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one?
The IUPAC name of 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one (CID 62036369) is 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one.
What is the SMILES notation for 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one?
The canonical SMILES for 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one is Cc1ccccc1CN(C)CC(=O)Cc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one?
The InChIKey is SECKOORAADZOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c1-14-7-3-4-9-16(14)12-20(2)13-17(21)11-15-8-5-6-10-18(15)19/h3-10H,11-13H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one?
1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one has a molecular weight of 285.36 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one is sourced from PubChem (CID 62036369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).