1,6-dimethyl-2,3-dihydroindole

C10H13N — CID 59833304

IUPAC1,6-dimethyl-2,3-dihydroindole
SMILESCc1ccc2c(c1)N(C)CC2
InChIInChI=1S/C10H13N/c1-8-3-4-9-5-6-11(2)10(9)7-8/h3-4,7H,5-6H2,1-2H3
InChIKeyQXSSYMHCIFVEMD-UHFFFAOYSA-N
MW147.22 g/mol
LogP1.99
Rot. Bonds

About 1,6-dimethyl-2,3-dihydroindole

1,6-dimethyl-2,3-dihydroindole (PubChem CID 59833304) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 1,6-dimethyl-2,3-dihydroindole.

Molecular Properties

Compound Name1,6-dimethyl-2,3-dihydroindole
PubChem CID59833304
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name1,6-dimethyl-2,3-dihydroindole
SMILESCc1ccc2c(c1)N(C)CC2
InChIInChI=1S/C10H13N/c1-8-3-4-9-5-6-11(2)10(9)7-8/h3-4,7H,5-6H2,1-2H3
InChIKeyQXSSYMHCIFVEMD-UHFFFAOYSA-N
XLogP1.99
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-bromo-1-methyl-2,3-dihydroindole
CID 13098380
ethane;1,4,6-trimethyl-2,3-dihydroquinoxaline
CID 91027227
6-ethynyl-1-methyl-2,3-dihydroindole
CID 130132980
1,2,6-trimethyl-3,4-dihydrocinnoline
CID 58095805
1,7-dimethyl-3,4-dihydroquinolin-2-one
CID 54207242
1-chloro-5-methyl-2,3-dihydroindole
CID 54202425
1-iodo-5-methyl-2,3-dihydroindole
CID 134548249
N,N,1-trimethyl-2,3-dihydroindole-6-carboxamide
CID 134369280
2-methyl-2-(1-methyl-2,3-dihydroindol-6-yl)propan-1-ol
CID 117294166
1-ethenylsulfonyl-6-methyl-2,3-dihydroindole
CID 143511464
6-methyl-2-propyl-3,4-dihydro-1H-isoquinoline
CID 89043863
methane;1-(5-methyl-2,3-dihydroindol-1-yl)ethanone
CID 159834618

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-2,3-dihydroindole?
The IUPAC name of 1,6-dimethyl-2,3-dihydroindole (CID 59833304) is 1,6-dimethyl-2,3-dihydroindole.
What is the SMILES notation for 1,6-dimethyl-2,3-dihydroindole?
The canonical SMILES for 1,6-dimethyl-2,3-dihydroindole is Cc1ccc2c(c1)N(C)CC2.
What is the InChIKey of 1,6-dimethyl-2,3-dihydroindole?
The InChIKey is QXSSYMHCIFVEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-8-3-4-9-5-6-11(2)10(9)7-8/h3-4,7H,5-6H2,1-2H3.
What are the key properties of 1,6-dimethyl-2,3-dihydroindole?
1,6-dimethyl-2,3-dihydroindole has a molecular weight of 147.22 g/mol, XLogP of 1.99, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-2,3-dihydroindole is sourced from PubChem (CID 59833304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).