2-methyl-2,3-dihydroindol-1-amine;hydrochloride

C9H13ClN2 — CID 2737616

IUPAC2-methyl-2,3-dihydroindol-1-amine;hydrochloride
SMILESCC1Cc2ccccc2N1N.Cl
InChIInChI=1S/C9H12N2.ClH/c1-7-6-8-4-2-3-5-9(8)11(7)10;/h2-5,7H,6,10H2,1H3;1H
InChIKeyRITRKULRSHGFQQ-UHFFFAOYSA-N
MW184.67 g/mol
LogP1.73
Rot. Bonds

About 2-methyl-2,3-dihydroindol-1-amine;hydrochloride

2-methyl-2,3-dihydroindol-1-amine;hydrochloride (PubChem CID 2737616) has the molecular formula C9H13ClN2 and a molecular weight of 184.67 g/mol. Its IUPAC name is 2-methyl-2,3-dihydroindol-1-amine;hydrochloride.

Molecular Properties

Compound Name2-methyl-2,3-dihydroindol-1-amine;hydrochloride
PubChem CID2737616
Molecular FormulaC9H13ClN2
Molecular Weight184.67 g/mol
Exact Mass184.08
IUPAC Name2-methyl-2,3-dihydroindol-1-amine;hydrochloride
SMILESCC1Cc2ccccc2N1N.Cl
InChIInChI=1S/C9H12N2.ClH/c1-7-6-8-4-2-3-5-9(8)11(7)10;/h2-5,7H,6,10H2,1H3;1H
InChIKeyRITRKULRSHGFQQ-UHFFFAOYSA-N
XLogP1.73
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.67
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,3-dihydroindol-1-amine;hydrochloride?
The IUPAC name of 2-methyl-2,3-dihydroindol-1-amine;hydrochloride (CID 2737616) is 2-methyl-2,3-dihydroindol-1-amine;hydrochloride.
What is the SMILES notation for 2-methyl-2,3-dihydroindol-1-amine;hydrochloride?
The canonical SMILES for 2-methyl-2,3-dihydroindol-1-amine;hydrochloride is CC1Cc2ccccc2N1N.Cl.
What is the InChIKey of 2-methyl-2,3-dihydroindol-1-amine;hydrochloride?
The InChIKey is RITRKULRSHGFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2.ClH/c1-7-6-8-4-2-3-5-9(8)11(7)10;/h2-5,7H,6,10H2,1H3;1H.
What are the key properties of 2-methyl-2,3-dihydroindol-1-amine;hydrochloride?
2-methyl-2,3-dihydroindol-1-amine;hydrochloride has a molecular weight of 184.67 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,3-dihydroindol-1-amine;hydrochloride is sourced from PubChem (CID 2737616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).