N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine

C16H12N4 — CID 58087251

IUPACN-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine
SMILESc1cnc2ccc(Nc3cnc4[nH]ccc4c3)cc2c1
InChIInChI=1S/C16H12N4/c1-2-11-8-13(3-4-15(11)17-6-1)20-14-9-12-5-7-18-16(12)19-10-14/h1-10,20H,(H,18,19)
InChIKeyYZFDTNWPZKDCLN-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.85
Rot. Bonds2

About N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine

N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine (PubChem CID 58087251) has the molecular formula C16H12N4 and a molecular weight of 260.30 g/mol. Its IUPAC name is N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine.

Molecular Properties

Compound NameN-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine
PubChem CID58087251
Molecular FormulaC16H12N4
Molecular Weight260.30 g/mol
Exact Mass260.11
IUPAC NameN-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine
SMILESc1cnc2ccc(Nc3cnc4[nH]ccc4c3)cc2c1
InChIInChI=1S/C16H12N4/c1-2-11-8-13(3-4-15(11)17-6-1)20-14-9-12-5-7-18-16(12)19-10-14/h1-10,20H,(H,18,19)
InChIKeyYZFDTNWPZKDCLN-UHFFFAOYSA-N
XLogP3.85
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 58086052
N-(3-methylsulfanylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 59506846
2-(quinolin-6-ylamino)pyridin-3-ol
CID 139352880
N-(4-ethyl-3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 138711418
2-N-quinolin-6-ylpyridine-2,3-diamine
CID 62634591
1-[4-(quinolin-6-ylamino)phenyl]ethanone
CID 82536653
2-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrrolo[3,2-b]pyridine
CID 134350502
N-(4,6-dihydrazinylpyrimidin-2-yl)quinolin-6-amine
CID 139976319
pyrimidin-2-amine;1H-pyrrolo[2,3-b]pyridine
CID 67326610
2-N-quinolin-6-yl-7H-purine-2,6-diamine
CID 117084904
N-ethyl-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 22273641
N-(2-chloro-5-iodopyrimidin-4-yl)quinolin-6-amine
CID 90052787

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine?
The IUPAC name of N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine (CID 58087251) is N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine.
What is the SMILES notation for N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine?
The canonical SMILES for N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine is c1cnc2ccc(Nc3cnc4[nH]ccc4c3)cc2c1.
What is the InChIKey of N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine?
The InChIKey is YZFDTNWPZKDCLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4/c1-2-11-8-13(3-4-15(11)17-6-1)20-14-9-12-5-7-18-16(12)19-10-14/h1-10,20H,(H,18,19).
What are the key properties of N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine?
N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine has a molecular weight of 260.30 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinolin-6-amine is sourced from PubChem (CID 58087251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).