4,7-dimethyl-3H-indol-2-amine

C10H12N2 — CID 145358846

IUPAC4,7-dimethyl-3H-indol-2-amine
SMILESCc1ccc(C)c2c1CC(N)=N2
InChIInChI=1S/C10H12N2/c1-6-3-4-7(2)10-8(6)5-9(11)12-10/h3-4H,5H2,1-2H3,(H2,11,12)
InChIKeyGOCBKGSOGNXYTK-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.85
Rot. Bonds

About 4,7-dimethyl-3H-indol-2-amine

4,7-dimethyl-3H-indol-2-amine (PubChem CID 145358846) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 4,7-dimethyl-3H-indol-2-amine.

Molecular Properties

Compound Name4,7-dimethyl-3H-indol-2-amine
PubChem CID145358846
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name4,7-dimethyl-3H-indol-2-amine
SMILESCc1ccc(C)c2c1CC(N)=N2
InChIInChI=1S/C10H12N2/c1-6-3-4-7(2)10-8(6)5-9(11)12-10/h3-4H,5H2,1-2H3,(H2,11,12)
InChIKeyGOCBKGSOGNXYTK-UHFFFAOYSA-N
XLogP1.85
TPSA38.38 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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-3H-indol-2-amine?
The IUPAC name of 4,7-dimethyl-3H-indol-2-amine (CID 145358846) is 4,7-dimethyl-3H-indol-2-amine.
What is the SMILES notation for 4,7-dimethyl-3H-indol-2-amine?
The canonical SMILES for 4,7-dimethyl-3H-indol-2-amine is Cc1ccc(C)c2c1CC(N)=N2.
What is the InChIKey of 4,7-dimethyl-3H-indol-2-amine?
The InChIKey is GOCBKGSOGNXYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-6-3-4-7(2)10-8(6)5-9(11)12-10/h3-4H,5H2,1-2H3,(H2,11,12).
What are the key properties of 4,7-dimethyl-3H-indol-2-amine?
4,7-dimethyl-3H-indol-2-amine has a molecular weight of 160.22 g/mol, XLogP of 1.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-3H-indol-2-amine is sourced from PubChem (CID 145358846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).