7-N-(1-aminoethenyl)-1H-indole-2,7-diamine

C10H12N4 — CID 143106569

IUPAC7-N-(1-aminoethenyl)-1H-indole-2,7-diamine
SMILESC=C(N)Nc1cccc2cc(N)[nH]c12
InChIInChI=1S/C10H12N4/c1-6(11)13-8-4-2-3-7-5-9(12)14-10(7)8/h2-5,13-14H,1,11-12H2
InChIKeyYPMBLCHZTKNYMC-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.59
Rot. Bonds2

About 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine

7-N-(1-aminoethenyl)-1H-indole-2,7-diamine (PubChem CID 143106569) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine.

Molecular Properties

Compound Name7-N-(1-aminoethenyl)-1H-indole-2,7-diamine
PubChem CID143106569
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name7-N-(1-aminoethenyl)-1H-indole-2,7-diamine
SMILESC=C(N)Nc1cccc2cc(N)[nH]c12
InChIInChI=1S/C10H12N4/c1-6(11)13-8-4-2-3-7-5-9(12)14-10(7)8/h2-5,13-14H,1,11-12H2
InChIKeyYPMBLCHZTKNYMC-UHFFFAOYSA-N
XLogP1.59
TPSA79.86 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine?
The IUPAC name of 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine (CID 143106569) is 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine.
What is the SMILES notation for 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine?
The canonical SMILES for 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine is C=C(N)Nc1cccc2cc(N)[nH]c12.
What is the InChIKey of 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine?
The InChIKey is YPMBLCHZTKNYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-6(11)13-8-4-2-3-7-5-9(12)14-10(7)8/h2-5,13-14H,1,11-12H2.
What are the key properties of 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine?
7-N-(1-aminoethenyl)-1H-indole-2,7-diamine has a molecular weight of 188.23 g/mol, XLogP of 1.59, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-(1-aminoethenyl)-1H-indole-2,7-diamine is sourced from PubChem (CID 143106569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).