(4-fluorophenyl)-(1-methylindol-2-yl)methanone

C16H12FNO — CID 10377568

IUPAC(4-fluorophenyl)-(1-methylindol-2-yl)methanone
SMILESCn1c(C(=O)c2ccc(F)cc2)cc2ccccc21
InChIInChI=1S/C16H12FNO/c1-18-14-5-3-2-4-12(14)10-15(18)16(19)11-6-8-13(17)9-7-11/h2-10H,1H3
InChIKeyFCIYNPJRTODLGV-UHFFFAOYSA-N
MW253.28 g/mol
LogP3.55
Rot. Bonds2

About (4-fluorophenyl)-(1-methylindol-2-yl)methanone

(4-fluorophenyl)-(1-methylindol-2-yl)methanone (PubChem CID 10377568) has the molecular formula C16H12FNO and a molecular weight of 253.28 g/mol. Its IUPAC name is (4-fluorophenyl)-(1-methylindol-2-yl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(1-methylindol-2-yl)methanone
PubChem CID10377568
Molecular FormulaC16H12FNO
Molecular Weight253.28 g/mol
Exact Mass253.09
IUPAC Name(4-fluorophenyl)-(1-methylindol-2-yl)methanone
SMILESCn1c(C(=O)c2ccc(F)cc2)cc2ccccc21
InChIInChI=1S/C16H12FNO/c1-18-14-5-3-2-4-12(14)10-15(18)16(19)11-6-8-13(17)9-7-11/h2-10H,1H3
InChIKeyFCIYNPJRTODLGV-UHFFFAOYSA-N
XLogP3.55
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-5-(1-methylindole-2-carbonyl)benzenesulfonamide
CID 21316646
[1-(4-fluorophenyl)indol-5-yl]-phenylmethanone
CID 134096101
3-(4-fluorophenyl)-3-[(1-methylindole-2-carbonyl)amino]propanoic acid
CID 167977206
N-[2-(4-fluorophenyl)sulfonylethyl]-1-methylindole-2-carboxamide
CID 71708611
(5-aminofuran-2-yl)-(1-methylindol-2-yl)methanone
CID 82374139
(4-fluorophenyl)-[4-(1-methylindol-2-yl)piperidin-1-yl]methanone
CID 113087934
methyl 1-methylindole-2-carboperoxoate
CID 140791750
(4-fluorophenyl)-[3-(1-methylindol-2-yl)pyrrolidin-1-yl]methanone
CID 113088434
2-(4-methoxybenzoyl)-1-methylquinolin-4-one
CID 15733027
phenyl 1-methylindole-2-carboxylate
CID 47299897
N'-(4-ethylbenzoyl)-1-methylindole-2-carbohydrazide
CID 55876077
6-fluoro-1-methylindole-2-carboxamide
CID 4777701

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(1-methylindol-2-yl)methanone?
The IUPAC name of (4-fluorophenyl)-(1-methylindol-2-yl)methanone (CID 10377568) is (4-fluorophenyl)-(1-methylindol-2-yl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(1-methylindol-2-yl)methanone?
The canonical SMILES for (4-fluorophenyl)-(1-methylindol-2-yl)methanone is Cn1c(C(=O)c2ccc(F)cc2)cc2ccccc21.
What is the InChIKey of (4-fluorophenyl)-(1-methylindol-2-yl)methanone?
The InChIKey is FCIYNPJRTODLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO/c1-18-14-5-3-2-4-12(14)10-15(18)16(19)11-6-8-13(17)9-7-11/h2-10H,1H3.
What are the key properties of (4-fluorophenyl)-(1-methylindol-2-yl)methanone?
(4-fluorophenyl)-(1-methylindol-2-yl)methanone has a molecular weight of 253.28 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(1-methylindol-2-yl)methanone is sourced from PubChem (CID 10377568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).