6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol

C16H12N4O2 — CID 135878293

IUPAC6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol
SMILESCc1ccc2c(-c3[nH]c4ncccc4c3N=O)c(O)[nH]c2c1
InChIInChI=1S/C16H12N4O2/c1-8-4-5-9-11(7-8)18-16(21)12(9)14-13(20-22)10-3-2-6-17-15(10)19-14/h2-7,18,21H,1H3,(H,17,19)
InChIKeyWUTPYEVWRXPYJQ-UHFFFAOYSA-N
MW292.30 g/mol
LogP4.12
Rot. Bonds2

About 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol

6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol (PubChem CID 135878293) has the molecular formula C16H12N4O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol.

Molecular Properties

Compound Name6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol
PubChem CID135878293
Molecular FormulaC16H12N4O2
Molecular Weight292.30 g/mol
Exact Mass292.10
IUPAC Name6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol
SMILESCc1ccc2c(-c3[nH]c4ncccc4c3N=O)c(O)[nH]c2c1
InChIInChI=1S/C16H12N4O2/c1-8-4-5-9-11(7-8)18-16(21)12(9)14-13(20-22)10-3-2-6-17-15(10)19-14/h2-7,18,21H,1H3,(H,17,19)
InChIKeyWUTPYEVWRXPYJQ-UHFFFAOYSA-N
XLogP4.12
TPSA94.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 54.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,6-dichloro-3-(3-nitroso-1H-indol-2-yl)-1H-indol-2-ol
CID 135499828
5-methyl-3-nitroso-1H-indol-2-ol
CID 583072
7-methyl-3-(3-nitroso-1H-indol-2-yl)-1H-indol-2-ol
CID 135779816
6-[(2S)-2-bromo-2-(2-hydroxyethoxy)ethyl]-3-(3-nitroso-1H-indol-2-yl)-1H-indol-2-ol
CID 174214658
9H-pyrido[2,3-b]indol-7-ol
CID 67086557
2-(2-hydroxy-5-methyl-1H-indol-3-yl)pyrrolo[2,3-b]pyridin-3-one
CID 135878278
2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
CID 84699413
3-[(Z)-3-nitrosobut-2-en-2-yl]-1H-pyrrolo[2,3-b]pyridin-2-ol
CID 137300610
hydroxylamine;14-methyl-17-nitroso-2,4,10-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(17),3(8),4,6,11(16),12,14-heptaen-9-one;14-methyl-2,4,10-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),4,6,11(16),12,14-heptaene-9,17-dione;hydrochloride
CID 158477016
6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol
CID 136996645
3,6-dimethyl-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
CID 113204984
3-(4-methylphenyl)-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 848491

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol?
The IUPAC name of 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol (CID 135878293) is 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol.
What is the SMILES notation for 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol?
The canonical SMILES for 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol is Cc1ccc2c(-c3[nH]c4ncccc4c3N=O)c(O)[nH]c2c1.
What is the InChIKey of 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol?
The InChIKey is WUTPYEVWRXPYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O2/c1-8-4-5-9-11(7-8)18-16(21)12(9)14-13(20-22)10-3-2-6-17-15(10)19-14/h2-7,18,21H,1H3,(H,17,19).
What are the key properties of 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol?
6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol has a molecular weight of 292.30 g/mol, XLogP of 4.12, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(3-nitroso-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indol-2-ol is sourced from PubChem (CID 135878293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).