4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine

C15H15N3O — CID 82376108

IUPAC4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine
SMILESCOc1ccc(-c2ccnc3c2c(N)cn3C)cc1
InChIInChI=1S/C15H15N3O/c1-18-9-13(16)14-12(7-8-17-15(14)18)10-3-5-11(19-2)6-4-10/h3-9H,16H2,1-2H3
InChIKeyDLBWTRLYOFZHBN-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.83
Rot. Bonds2

About 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine

4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine (PubChem CID 82376108) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine
PubChem CID82376108
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine
SMILESCOc1ccc(-c2ccnc3c2c(N)cn3C)cc1
InChIInChI=1S/C15H15N3O/c1-18-9-13(16)14-12(7-8-17-15(14)18)10-3-5-11(19-2)6-4-10/h3-9H,16H2,1-2H3
InChIKeyDLBWTRLYOFZHBN-UHFFFAOYSA-N
XLogP2.83
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-3-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridine
CID 170855643
4-(4-chloro-7-methylpyrrolo[2,3-d]pyrimidin-5-yl)aniline
CID 122512826
4-(4-methoxyphenyl)-1H-indazol-3-amine
CID 118046988
3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 71150900
13-(4-methoxyphenyl)-8-thia-5,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene
CID 139824152
4-(4-methoxyphenyl)-3-pyridin-4-yl-2H-pyrazolo[3,4-b]pyridine
CID 155569359
4-chloro-3-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine
CID 90226236
2-chloro-4-(4-methoxyphenyl)pyridine-3-carbaldehyde
CID 164894115
N-(4-acetamidophenyl)-2-[4-(4-methoxyphenyl)-3-methylpyrazolo[3,4-b]pyridin-1-yl]acetamide
CID 19505966
4-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 66827127
2-[2-(4-methoxyphenyl)phenyl]-1H-imidazole
CID 11736810
4-(4-bromophenyl)-7-(4-methoxyphenyl)-1,10-phenanthroline
CID 57357110

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine?
The IUPAC name of 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine (CID 82376108) is 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine is COc1ccc(-c2ccnc3c2c(N)cn3C)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine?
The InChIKey is DLBWTRLYOFZHBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-9-13(16)14-12(7-8-17-15(14)18)10-3-5-11(19-2)6-4-10/h3-9H,16H2,1-2H3.
What are the key properties of 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine?
4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine has a molecular weight of 253.31 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-methylpyrrolo[2,3-b]pyridin-3-amine is sourced from PubChem (CID 82376108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).