2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one

C12H11NO — CID 12820627

IUPAC2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one
SMILESCC1Cc2cc3ccccc3n2C1=O
InChIInChI=1S/C12H11NO/c1-8-6-10-7-9-4-2-3-5-11(9)13(10)12(8)14/h2-5,7-8H,6H2,1H3
InChIKeyQKXOLQDIQFFZLR-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.47
Rot. Bonds

About 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one

2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one (PubChem CID 12820627) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one.

Molecular Properties

Compound Name2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one
PubChem CID12820627
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one
SMILESCC1Cc2cc3ccccc3n2C1=O
InChIInChI=1S/C12H11NO/c1-8-6-10-7-9-4-2-3-5-11(9)13(10)12(8)14/h2-5,7-8H,6H2,1H3
InChIKeyQKXOLQDIQFFZLR-UHFFFAOYSA-N
XLogP2.47
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 1-oxo-2,3-dihydropyrrolo[1,2-a]indole-2-carboxylate
CID 134303472
ethyl 1-oxo-2,3-dihydropyrrolo[1,2-a]indole-2-carboxylate
CID 67807991
1,3-dimethyl-3,4-dihydro-[1,3,2]oxazaphosphinino[3,4-a]indole
CID 22894615
3-[2-(2-bromophenyl)indol-1-yl]-5-methylcyclohex-2-en-1-one
CID 164671340
8,9-dihydro-6H-pyrido[1,2-a]indol-7-one
CID 15063399
1,4-dimethyl-6-(2-oxoquinolin-1-yl)-3,4-dihydroquinolin-2-one
CID 89445360
9-amino-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one
CID 10821901
11-methyl-1,11,12,13-tetrazatetracyclo[7.6.0.02,7.010,14]pentadeca-2,4,6,8,12-pentaen-15-one
CID 68561888
8-chloro-3-methyl-3,4-dihydro-[1,3]oxazino[3,4-a]indol-1-one
CID 71349209
3H-pyrazino[1,2-a]indol-4-one
CID 141364552
9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole
CID 15287247
6,7,8,9-tetrahydropyrido[1,2-a]indol-8-ol
CID 115017308

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one?
The IUPAC name of 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one (CID 12820627) is 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one.
What is the SMILES notation for 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one?
The canonical SMILES for 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one is CC1Cc2cc3ccccc3n2C1=O.
What is the InChIKey of 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one?
The InChIKey is QKXOLQDIQFFZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c1-8-6-10-7-9-4-2-3-5-11(9)13(10)12(8)14/h2-5,7-8H,6H2,1H3.
What are the key properties of 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one?
2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one has a molecular weight of 185.23 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,3-dihydropyrrolo[1,2-a]indol-1-one is sourced from PubChem (CID 12820627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).