[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone

C20H16FNO — CID 110823801

IUPAC[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1cccc(NCc2ccccc2F)c1
InChIInChI=1S/C20H16FNO/c21-19-12-5-4-9-17(19)14-22-18-11-6-10-16(13-18)20(23)15-7-2-1-3-8-15/h1-13,22H,14H2
InChIKeyKVLAGMQNJXHALC-UHFFFAOYSA-N
MW305.35 g/mol
LogP4.67
Rot. Bonds5

About [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone

[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone (PubChem CID 110823801) has the molecular formula C20H16FNO and a molecular weight of 305.35 g/mol. Its IUPAC name is [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone
PubChem CID110823801
Molecular FormulaC20H16FNO
Molecular Weight305.35 g/mol
Exact Mass305.12
IUPAC Name[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1cccc(NCc2ccccc2F)c1
InChIInChI=1S/C20H16FNO/c21-19-12-5-4-9-17(19)14-22-18-11-6-10-16(13-18)20(23)15-7-2-1-3-8-15/h1-13,22H,14H2
InChIKeyKVLAGMQNJXHALC-UHFFFAOYSA-N
XLogP4.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.35
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-[3-(4-tert-butylbenzoyl)phenyl]-1-(2-fluorophenyl)methanesulfonamide
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2-[2-[(3-fluoroanilino)methyl]phenyl]acetic acid
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2-fluoro-5-[(2-fluorophenyl)methylamino]benzamide
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2-(3-benzoylanilino)-1-(4-chlorophenyl)ethanone
CID 110823607
3-acetamido-N-[(2-fluorophenyl)methyl]benzamide
CID 8012881
N-[[3-[(2-fluorophenyl)methylamino]phenyl]methyl]-N-methylacetamide
CID 43433505
3-[[2-[(2-fluorophenyl)methylamino]-6-methylpyrimidin-4-yl]amino]benzoic acid
CID 113194431
1-N-[(2-fluorophenyl)methyl]-3-N,3-N-dimethylbenzene-1,3-diamine
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Frequently Asked Questions

What is the IUPAC name of [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone?
The IUPAC name of [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone (CID 110823801) is [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone.
What is the SMILES notation for [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone?
The canonical SMILES for [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone is O=C(c1ccccc1)c1cccc(NCc2ccccc2F)c1.
What is the InChIKey of [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone?
The InChIKey is KVLAGMQNJXHALC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO/c21-19-12-5-4-9-17(19)14-22-18-11-6-10-16(13-18)20(23)15-7-2-1-3-8-15/h1-13,22H,14H2.
What are the key properties of [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone?
[3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone has a molecular weight of 305.35 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-fluorophenyl)methylamino]phenyl]-phenylmethanone is sourced from PubChem (CID 110823801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).