N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine

C22H26N4O — CID 143151648

IUPACN-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESC=C(c1cnc(Nc2cccc(OC)c2)c2ccn(C)c12)N1CCCCC1
InChIInChI=1S/C22H26N4O/c1-16(26-11-5-4-6-12-26)20-15-23-22(19-10-13-25(2)21(19)20)24-17-8-7-9-18(14-17)27-3/h7-10,13-15H,1,4-6,11-12H2,2-3H3,(H,23,24)
InChIKeyOJIDIYGGQZSVAA-UHFFFAOYSA-N
MW362.48 g/mol
LogP4.78
Rot. Bonds5

About N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine

N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine (PubChem CID 143151648) has the molecular formula C22H26N4O and a molecular weight of 362.48 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine
PubChem CID143151648
Molecular FormulaC22H26N4O
Molecular Weight362.48 g/mol
Exact Mass362.21
IUPAC NameN-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESC=C(c1cnc(Nc2cccc(OC)c2)c2ccn(C)c12)N1CCCCC1
InChIInChI=1S/C22H26N4O/c1-16(26-11-5-4-6-12-26)20-15-23-22(19-10-13-25(2)21(19)20)24-17-8-7-9-18(14-17)27-3/h7-10,13-15H,1,4-6,11-12H2,2-3H3,(H,23,24)
InChIKeyOJIDIYGGQZSVAA-UHFFFAOYSA-N
XLogP4.78
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-fluoro-5-[[1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-yl]amino]phenol
CID 143151631
N-(5-fluoro-2-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine
CID 89229930
[4-(3-chloro-4-methoxyanilino)-1-methylpyrrolo[3,2-c]pyridin-7-yl]-piperidin-1-ylmethanone;hydrochloride
CID 68867364
2-fluoro-5-[[1-methyl-7-(1-morpholin-4-ylethenyl)pyrrolo[3,2-c]pyridin-4-yl]amino]phenol
CID 89229974
(1,1-dihydroxy-1,4-thiazinan-4-yl)-[1-methyl-4-[3-(trifluoromethoxy)anilino]pyrrolo[3,2-c]pyridin-7-yl]methanone
CID 68867378
4-(3-chloroanilino)-1-methylpyrrolo[3,2-c]pyridine-7-carboxylic acid;N-methylcyclohexanamine;hydrochloride
CID 68869752
[7-(3-methoxyanilino)-3-methyl-1H-pyrrolo[2,3-c]pyridin-4-yl]-piperidin-1-ylmethanone;hydrochloride
CID 68867211
[4-(5-methoxy-2-methylanilino)-1-methylpyrrolo[3,2-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride
CID 68868590
1-methyl-N-(3-methylphenyl)-7-(piperidin-1-ylmethyl)pyrrolo[3,2-c]pyridin-4-amine
CID 163535514
azepan-1-yl-[5-(3-methoxyanilino)-2-pyridinyl]methanone
CID 109196797
[6-fluoro-4-(3-methoxyanilino)quinolin-3-yl]-piperidin-1-ylmethanone
CID 53001502
[4-[2-methoxy-5-(trifluoromethyl)anilino]-1-methylpyrrolo[3,2-c]pyridin-7-yl]-piperidin-1-ylmethanone;hydrochloride
CID 68869763

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine (CID 143151648) is N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine is C=C(c1cnc(Nc2cccc(OC)c2)c2ccn(C)c12)N1CCCCC1.
What is the InChIKey of N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is OJIDIYGGQZSVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O/c1-16(26-11-5-4-6-12-26)20-15-23-22(19-10-13-25(2)21(19)20)24-17-8-7-9-18(14-17)27-3/h7-10,13-15H,1,4-6,11-12H2,2-3H3,(H,23,24).
What are the key properties of N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine?
N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 362.48 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1-methyl-7-(1-piperidin-1-ylethenyl)pyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 143151648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).