[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone

C17H18N2O — CID 62173307

IUPAC[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCNc1ccc(C(=O)N2c3ccccc3CC2C)cc1
InChIInChI=1S/C17H18N2O/c1-12-11-14-5-3-4-6-16(14)19(12)17(20)13-7-9-15(18-2)10-8-13/h3-10,12,18H,11H2,1-2H3
InChIKeyYHZYQCQPLYOFOF-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.32
Rot. Bonds2

About [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone

[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone (PubChem CID 62173307) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
PubChem CID62173307
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCNc1ccc(C(=O)N2c3ccccc3CC2C)cc1
InChIInChI=1S/C17H18N2O/c1-12-11-14-5-3-4-6-16(14)19(12)17(20)13-7-9-15(18-2)10-8-13/h3-10,12,18H,11H2,1-2H3
InChIKeyYHZYQCQPLYOFOF-UHFFFAOYSA-N
XLogP3.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
(4-tert-butylphenyl)-[(2R)-2-methyl-2,3-dihydroindol-1-yl]methanone
CID 42065881
1-[4-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]-3-propan-2-ylurea
CID 71889672
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(4-propan-2-ylphenyl)methanone
CID 26910929
N-tert-butyl-4-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 48845425
[4-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl] acetate
CID 7336980
N-[4-[[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]amino]phenyl]acetamide
CID 109164561
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone
CID 26910884
methyl 4-[[5-(2-methyl-2,3-dihydroindole-1-carbonyl)-2-pyridinyl]amino]benzoate
CID 109164639
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 92533173
5-(2-methyl-2,3-dihydroindole-1-carbonyl)-1H-pyridin-2-one
CID 43083133
[6-(ethylamino)-3-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62172788

Frequently Asked Questions

What is the IUPAC name of [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The IUPAC name of [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone (CID 62173307) is [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone is CNc1ccc(C(=O)N2c3ccccc3CC2C)cc1.
What is the InChIKey of [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The InChIKey is YHZYQCQPLYOFOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12-11-14-5-3-4-6-16(14)19(12)17(20)13-7-9-15(18-2)10-8-13/h3-10,12,18H,11H2,1-2H3.
What are the key properties of [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone?
[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone has a molecular weight of 266.34 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 62173307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).