1,2-dimethylindol-5-amine

C10H12N2 — CID 6484710

IUPAC1,2-dimethylindol-5-amine
SMILESCc1cc2cc(N)ccc2n1C
InChIInChI=1S/C10H12N2/c1-7-5-8-6-9(11)3-4-10(8)12(7)2/h3-6H,11H2,1-2H3
InChIKeyKCRFAMHLOPLVJF-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.07
Rot. Bonds

About 1,2-dimethylindol-5-amine

1,2-dimethylindol-5-amine (PubChem CID 6484710) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 1,2-dimethylindol-5-amine.

Molecular Properties

Compound Name1,2-dimethylindol-5-amine
PubChem CID6484710
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name1,2-dimethylindol-5-amine
SMILESCc1cc2cc(N)ccc2n1C
InChIInChI=1S/C10H12N2/c1-7-5-8-6-9(11)3-4-10(8)12(7)2/h3-6H,11H2,1-2H3
InChIKeyKCRFAMHLOPLVJF-UHFFFAOYSA-N
XLogP2.07
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Skatole
CID 6736
Tryptamine
CID 1150
N,N-Dimethyltryptamine
CID 6089
Pyrvinium
CID 5281035
Gramine
CID 6890
(+-)-alpha-Methyltryptamine
CID 9287
Methyltryptamine
CID 6088
Iprindole
CID 21722
N,N-Diethyltryptamine
CID 6090
2-Methylindole
CID 7224
Mebhydrolin
CID 22530
2,3-Dimethylindole
CID 7053

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylindol-5-amine?
The IUPAC name of 1,2-dimethylindol-5-amine (CID 6484710) is 1,2-dimethylindol-5-amine.
What is the SMILES notation for 1,2-dimethylindol-5-amine?
The canonical SMILES for 1,2-dimethylindol-5-amine is Cc1cc2cc(N)ccc2n1C.
What is the InChIKey of 1,2-dimethylindol-5-amine?
The InChIKey is KCRFAMHLOPLVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-7-5-8-6-9(11)3-4-10(8)12(7)2/h3-6H,11H2,1-2H3.
What are the key properties of 1,2-dimethylindol-5-amine?
1,2-dimethylindol-5-amine has a molecular weight of 160.22 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylindol-5-amine is sourced from PubChem (CID 6484710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).