2-methyl-1H-indol-3-amine;hydrochloride

C9H11ClN2 — CID 122163532

IUPAC2-methyl-1H-indol-3-amine;hydrochloride
SMILESCc1[nH]c2ccccc2c1N.Cl
InChIInChI=1S/C9H10N2.ClH/c1-6-9(10)7-4-2-3-5-8(7)11-6;/h2-5,11H,10H2,1H3;1H
InChIKeyVYQNCVXNIUYWKU-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.48
Rot. Bonds

About 2-methyl-1H-indol-3-amine;hydrochloride

2-methyl-1H-indol-3-amine;hydrochloride (PubChem CID 122163532) has the molecular formula C9H11ClN2 and a molecular weight of 182.65 g/mol. Its IUPAC name is 2-methyl-1H-indol-3-amine;hydrochloride.

Molecular Properties

Compound Name2-methyl-1H-indol-3-amine;hydrochloride
PubChem CID122163532
Molecular FormulaC9H11ClN2
Molecular Weight182.65 g/mol
Exact Mass182.06
IUPAC Name2-methyl-1H-indol-3-amine;hydrochloride
SMILESCc1[nH]c2ccccc2c1N.Cl
InChIInChI=1S/C9H10N2.ClH/c1-6-9(10)7-4-2-3-5-8(7)11-6;/h2-5,11H,10H2,1H3;1H
InChIKeyVYQNCVXNIUYWKU-UHFFFAOYSA-N
XLogP2.48
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1H-indol-3-amine;hydrochloride?
The IUPAC name of 2-methyl-1H-indol-3-amine;hydrochloride (CID 122163532) is 2-methyl-1H-indol-3-amine;hydrochloride.
What is the SMILES notation for 2-methyl-1H-indol-3-amine;hydrochloride?
The canonical SMILES for 2-methyl-1H-indol-3-amine;hydrochloride is Cc1[nH]c2ccccc2c1N.Cl.
What is the InChIKey of 2-methyl-1H-indol-3-amine;hydrochloride?
The InChIKey is VYQNCVXNIUYWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.ClH/c1-6-9(10)7-4-2-3-5-8(7)11-6;/h2-5,11H,10H2,1H3;1H.
What are the key properties of 2-methyl-1H-indol-3-amine;hydrochloride?
2-methyl-1H-indol-3-amine;hydrochloride has a molecular weight of 182.65 g/mol, XLogP of 2.48, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1H-indol-3-amine;hydrochloride is sourced from PubChem (CID 122163532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).