N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine

C13H10N4O — CID 143384635

IUPACN-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESO=Nc1cccc(Nc2ccnc3[nH]ccc23)c1
InChIInChI=1S/C13H10N4O/c18-17-10-3-1-2-9(8-10)16-12-5-7-15-13-11(12)4-6-14-13/h1-8H,(H2,14,15,16)
InChIKeyGYMOAYDQNXIXBD-UHFFFAOYSA-N
MW238.25 g/mol
LogP3.70
Rot. Bonds3

About N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine

N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine (PubChem CID 143384635) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine.

Molecular Properties

Compound NameN-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine
PubChem CID143384635
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC NameN-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine
SMILESO=Nc1cccc(Nc2ccnc3[nH]ccc23)c1
InChIInChI=1S/C13H10N4O/c18-17-10-3-1-2-9(8-10)16-12-5-7-15-13-11(12)4-6-14-13/h1-8H,(H2,14,15,16)
InChIKeyGYMOAYDQNXIXBD-UHFFFAOYSA-N
XLogP3.70
TPSA70.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1H-pyrrolo[2,3-b]pyridin-4-ylamino)benzoic acid
CID 58086793
1-N-methyl-4-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,4-diamine
CID 143384741
3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)benzamide
CID 166205015
N-(3-chlorophenyl)-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrimidin-2-amine
CID 11957767
2-(1H-pyrrolo[2,3-b]pyridin-4-ylamino)thiophene-3-carbaldehyde
CID 89118347
2-oxo-5-[3-(sulfinatoamino)anilino]-1H-1,8-naphthyridine;dihydrochloride
CID 170349625
N'-(1H-pyrrolo[2,3-b]pyridin-4-yl)ethane-1,2-diamine
CID 84655641
3-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzamide
CID 57482985
N-methyl-N-[3-[2-(3-nitrosoanilino)pyrimidin-4-yl]phenyl]methanesulfonamide
CID 89267402
5-[3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethylamino)phenyl]pyrrolidin-2-one
CID 167950434
N-(3-phenoxyphenyl)quinolin-4-amine
CID 44531074
7-chloro-N-(3-methoxyphenyl)quinolin-4-amine
CID 50877151

Frequently Asked Questions

What is the IUPAC name of N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine?
The IUPAC name of N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine (CID 143384635) is N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine.
What is the SMILES notation for N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine?
The canonical SMILES for N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine is O=Nc1cccc(Nc2ccnc3[nH]ccc23)c1.
What is the InChIKey of N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine?
The InChIKey is GYMOAYDQNXIXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c18-17-10-3-1-2-9(8-10)16-12-5-7-15-13-11(12)4-6-14-13/h1-8H,(H2,14,15,16).
What are the key properties of N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine?
N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine has a molecular weight of 238.25 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-nitrosophenyl)-1H-pyrrolo[2,3-b]pyridin-4-amine is sourced from PubChem (CID 143384635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).