6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine

C20H16N6 — CID 163442884

IUPAC6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine
SMILESNc1cc2cc3[nH]c(-c4cc5cc6[nH]c(N)cc6cc5[nH]4)cc3cc2[nH]1
InChIInChI=1S/C20H16N6/c21-19-7-11-3-13-9(1-15(11)25-19)5-17(23-13)18-6-10-2-16-12(4-14(10)24-18)8-20(22)26-16/h1-8,23-26H,21-22H2
InChIKeyBAAQIFKNMWFRLX-UHFFFAOYSA-N
MW340.39 g/mol
LogP4.44
Rot. Bonds1

About 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine

6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine (PubChem CID 163442884) has the molecular formula C20H16N6 and a molecular weight of 340.39 g/mol. Its IUPAC name is 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine.

Molecular Properties

Compound Name6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine
PubChem CID163442884
Molecular FormulaC20H16N6
Molecular Weight340.39 g/mol
Exact Mass340.14
IUPAC Name6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine
SMILESNc1cc2cc3[nH]c(-c4cc5cc6[nH]c(N)cc6cc5[nH]4)cc3cc2[nH]1
InChIInChI=1S/C20H16N6/c21-19-7-11-3-13-9(1-15(11)25-19)5-17(23-13)18-6-10-2-16-12(4-14(10)24-18)8-20(22)26-16/h1-8,23-26H,21-22H2
InChIKeyBAAQIFKNMWFRLX-UHFFFAOYSA-N
XLogP4.44
TPSA115.20 Ų
H-Bond Donors6
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.39
LogP ≤ 54.44
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 102

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Related Compounds

5-phenyl-1H-indol-2-amine
CID 154370356
5-methyl-2-(4-methylphenyl)-1H-indol-6-amine
CID 82389166
3-(5-amino-6-fluoro-1H-indol-2-yl)phenol
CID 82387044
3-(5-chloro-1H-indol-2-yl)aniline
CID 39347249
5-chloro-2-(1H-pyrrol-3-yl)-1H-indol-6-amine
CID 96599329
4-(5-methyl-1H-indol-2-yl)aniline
CID 15322512
4-(6-fluoro-1H-indol-2-yl)aniline
CID 71602423
2-amino-1,4-dihydropyrrolo[3,2-b]pyrrol-5-ol
CID 69289832
2-phenyl-1H-indole-6-carboxamide
CID 69443786
2-amino-N,N-dimethyl-1H-indole-6-sulfonamide
CID 90823817
5-(5-fluoro-1H-indol-2-yl)-1H-pyrazol-3-amine
CID 136985649
[2-(4-aminophenyl)-1H-indol-6-yl]-methyl-oxoazanium
CID 91423527

Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine?
The IUPAC name of 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine (CID 163442884) is 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine.
What is the SMILES notation for 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine?
The canonical SMILES for 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine is Nc1cc2cc3[nH]c(-c4cc5cc6[nH]c(N)cc6cc5[nH]4)cc3cc2[nH]1.
What is the InChIKey of 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine?
The InChIKey is BAAQIFKNMWFRLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6/c21-19-7-11-3-13-9(1-15(11)25-19)5-17(23-13)18-6-10-2-16-12(4-14(10)24-18)8-20(22)26-16/h1-8,23-26H,21-22H2.
What are the key properties of 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine?
6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine has a molecular weight of 340.39 g/mol, XLogP of 4.44, 1 rotatable bonds, 6 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-1,5-dihydropyrrolo[2,3-f]indol-6-yl)-1,5-dihydropyrrolo[2,3-f]indol-2-amine is sourced from PubChem (CID 163442884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).