(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone

C17H15NO — CID 43339223

IUPAC(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1c(C)[nH]c2ccccc12
InChIInChI=1S/C17H15NO/c1-11-7-3-4-8-13(11)17(19)16-12(2)18-15-10-6-5-9-14(15)16/h3-10,18H,1-2H3
InChIKeyQMHZGRXXTLEDMH-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.02
Rot. Bonds2

About (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone

(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone (PubChem CID 43339223) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone.

Molecular Properties

Compound Name(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone
PubChem CID43339223
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1c(C)[nH]c2ccccc12
InChIInChI=1S/C17H15NO/c1-11-7-3-4-8-13(11)17(19)16-12(2)18-15-10-6-5-9-14(15)16/h3-10,18H,1-2H3
InChIKeyQMHZGRXXTLEDMH-UHFFFAOYSA-N
XLogP4.02
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

anthracen-1-yl-(2-methyl-1H-indol-3-yl)methanone
CID 10065533
(2,4-dichlorophenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 43339192
(2,4-dibromophenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 107949694
CID 170645728
CID 170645728
(2-chloro-4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 43339219
methyl 2-methyl-1H-indole-3-carboxylate
CID 594174
N,2-dimethyl-1H-indole-3-carboxamide
CID 20800690
4-(2-methyl-1H-indole-3-carbonyl)benzonitrile
CID 10422724
(E)-4-(2-methyl-1H-indol-3-yl)pent-3-en-2-one
CID 66575320
(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone
CID 43463185
ethane;(2-methyl-1H-indol-3-yl)-(6-methyl-2-pyridinyl)methanone
CID 161168956
4,4-bis(2-methyl-1H-indol-3-yl)but-3-en-2-one
CID 134840474

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone?
The IUPAC name of (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone (CID 43339223) is (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone.
What is the SMILES notation for (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone?
The canonical SMILES for (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone is Cc1ccccc1C(=O)c1c(C)[nH]c2ccccc12.
What is the InChIKey of (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone?
The InChIKey is QMHZGRXXTLEDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-11-7-3-4-8-13(11)17(19)16-12(2)18-15-10-6-5-9-14(15)16/h3-10,18H,1-2H3.
What are the key properties of (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone?
(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone has a molecular weight of 249.31 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone is sourced from PubChem (CID 43339223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).