6-methyl-2,3-dihydro-1H-isoindol-1-amine

C9H12N2 — CID 20773265

IUPAC6-methyl-2,3-dihydro-1H-isoindol-1-amine
SMILESCc1ccc2c(c1)C(N)NC2
InChIInChI=1S/C9H12N2/c1-6-2-3-7-5-11-9(10)8(7)4-6/h2-4,9,11H,5,10H2,1H3
InChIKeyQOBZRJUWUZARDX-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.06
Rot. Bonds

About 6-methyl-2,3-dihydro-1H-isoindol-1-amine

6-methyl-2,3-dihydro-1H-isoindol-1-amine (PubChem CID 20773265) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 6-methyl-2,3-dihydro-1H-isoindol-1-amine.

Molecular Properties

Compound Name6-methyl-2,3-dihydro-1H-isoindol-1-amine
PubChem CID20773265
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name6-methyl-2,3-dihydro-1H-isoindol-1-amine
SMILESCc1ccc2c(c1)C(N)NC2
InChIInChI=1S/C9H12N2/c1-6-2-3-7-5-11-9(10)8(7)4-6/h2-4,9,11H,5,10H2,1H3
InChIKeyQOBZRJUWUZARDX-UHFFFAOYSA-N
XLogP1.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-2,3-dihydro-1H-isoindol-1-amine
CID 145207105
1-(4-fluorophenyl)-6-methyl-2,3-dihydro-1H-isoindole
CID 84735923
[(1R)-6-methyl-2,3-dihydro-1H-isoindol-1-yl]methanol
CID 130741067
1-cycloheptyl-6-methyl-2,3-dihydro-1H-isoindole
CID 84736095
2-(6-methyl-2,3-dihydro-1H-isoindol-1-yl)-2-oxoacetaldehyde
CID 174734512
4-fluoro-6-methyl-1,2,3,4-tetrahydroisoquinoline
CID 84717063
(1R)-2,6-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 130738908
6-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 50988168
(4R)-6-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 9170420
(6aS,12bR)-2-methyl-5,6,6a,7,8,12b-hexahydrobenzo[a]phenanthridine-10,11-diol
CID 57340488
6,8-dimethyl-1,2,3,4,5,6-hexahydro-2-benzazocine
CID 163872656
3-fluoro-6-methyl-1,2,3,4-tetrahydroisoquinoline
CID 123699781

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,3-dihydro-1H-isoindol-1-amine?
The IUPAC name of 6-methyl-2,3-dihydro-1H-isoindol-1-amine (CID 20773265) is 6-methyl-2,3-dihydro-1H-isoindol-1-amine.
What is the SMILES notation for 6-methyl-2,3-dihydro-1H-isoindol-1-amine?
The canonical SMILES for 6-methyl-2,3-dihydro-1H-isoindol-1-amine is Cc1ccc2c(c1)C(N)NC2.
What is the InChIKey of 6-methyl-2,3-dihydro-1H-isoindol-1-amine?
The InChIKey is QOBZRJUWUZARDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-6-2-3-7-5-11-9(10)8(7)4-6/h2-4,9,11H,5,10H2,1H3.
What are the key properties of 6-methyl-2,3-dihydro-1H-isoindol-1-amine?
6-methyl-2,3-dihydro-1H-isoindol-1-amine has a molecular weight of 148.21 g/mol, XLogP of 1.06, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,3-dihydro-1H-isoindol-1-amine is sourced from PubChem (CID 20773265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).