2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine

C21H19N3O2 — CID 71448856

IUPAC2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
SMILESCOc1ccc(Nc2nccc3[nH]c(-c4cccc(OC)c4)cc23)cc1
InChIInChI=1S/C21H19N3O2/c1-25-16-8-6-15(7-9-16)23-21-18-13-20(24-19(18)10-11-22-21)14-4-3-5-17(12-14)26-2/h3-13,24H,1-2H3,(H,22,23)
InChIKeyPFOWOXZGNMXJLH-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.99
Rot. Bonds5

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

2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine (PubChem CID 71448856) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
PubChem CID71448856
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
SMILESCOc1ccc(Nc2nccc3[nH]c(-c4cccc(OC)c4)cc23)cc1
InChIInChI=1S/C21H19N3O2/c1-25-16-8-6-15(7-9-16)23-21-18-13-20(24-19(18)10-11-22-21)14-4-3-5-17(12-14)26-2/h3-13,24H,1-2H3,(H,22,23)
InChIKeyPFOWOXZGNMXJLH-UHFFFAOYSA-N
XLogP4.99
TPSA59.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenyl)-N-(4-phenoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 155554853
N-(3-fluorophenyl)-2-(3-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 71728538
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 71447602
N-(3,4-dimethoxyphenyl)-2-(3-fluorophenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 71729772
N-(4-methylphenyl)-2-phenyl-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 144764894
ethane;6-(3-methoxyphenyl)-N-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 143080945
2-(3-fluorophenyl)-N-(4-methoxyphenyl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 71447355
2-(2-methoxyphenyl)-N-(4-propan-2-ylphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 71729393
6-(3-methoxyphenyl)-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 135836115
N-[4-(chloromethyl)phenyl]-6-methoxyisoquinolin-1-amine
CID 106542706
4-methoxy-2-(4-methoxyphenyl)-1H-indole
CID 159214029
6-fluoro-2-(3-methoxyphenyl)-1H-quinolin-4-one
CID 22481024

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine (CID 71448856) is 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine is COc1ccc(Nc2nccc3[nH]c(-c4cccc(OC)c4)cc23)cc1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is PFOWOXZGNMXJLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-25-16-8-6-15(7-9-16)23-21-18-13-20(24-19(18)10-11-22-21)14-4-3-5-17(12-14)26-2/h3-13,24H,1-2H3,(H,22,23).
What are the key properties of 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine?
2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 345.40 g/mol, XLogP of 4.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 71448856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).