4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine

C23H24N6O — CID 146316045

IUPAC4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
SMILESCc1nc2ccc(-c3ccnc(N)c3)nc2n1-c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C23H24N6O/c1-16-26-21-6-5-20(18-7-8-25-22(24)14-18)27-23(21)29(16)19-4-2-3-17(13-19)15-28-9-11-30-12-10-28/h2-8,13-14H,9-12,15H2,1H3,(H2,24,25)
InChIKeyCAIFTIXFYHSKFZ-UHFFFAOYSA-N
MW400.49 g/mol
LogP3.21
Rot. Bonds4

About 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine

4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine (PubChem CID 146316045) has the molecular formula C23H24N6O and a molecular weight of 400.49 g/mol. Its IUPAC name is 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
PubChem CID146316045
Molecular FormulaC23H24N6O
Molecular Weight400.49 g/mol
Exact Mass400.20
IUPAC Name4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
SMILESCc1nc2ccc(-c3ccnc(N)c3)nc2n1-c1cccc(CN2CCOCC2)c1
InChIInChI=1S/C23H24N6O/c1-16-26-21-6-5-20(18-7-8-25-22(24)14-18)27-23(21)29(16)19-4-2-3-17(13-19)15-28-9-11-30-12-10-28/h2-8,13-14H,9-12,15H2,1H3,(H2,24,25)
InChIKeyCAIFTIXFYHSKFZ-UHFFFAOYSA-N
XLogP3.21
TPSA82.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.49
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[2-methyl-3-[4-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 146316096
4-[3-(3-chloro-4-morpholin-4-ylphenyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 146316018
4-[3-[3,5-dichloro-4-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 171629668
4-[3-[4-(2,6-diazaspiro[3.3]heptan-2-yl)-3,5-difluorophenyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 171629472
4-[3-[3-fluoro-4-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]phenyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 171629460
ethane;4-[3-[3-fluoro-4-[(2S,5S)-2,4,5-trimethylpiperazin-1-yl]phenyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridin-2-amine
CID 171629564
4-[(3-quinolin-2-ylphenyl)methyl]morpholine
CID 50980839
4-[[3-(6-methoxy-2-pyridinyl)phenyl]methyl]morpholine
CID 50962081
6-[3-(piperidin-1-ylmethyl)phenyl]pyrido[2,3-b]pyrazine
CID 46196307
5-[3-(morpholin-4-ylmethyl)phenyl]pyrimidine-2,4-diamine
CID 66637304
4-[3-[3-phenyl-2-(1H-pyrazol-5-yl)imidazo[4,5-b]pyridin-5-yl]phenyl]morpholine
CID 71138371
3-[[16-[(3-aminophenyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]aniline
CID 15495103

Frequently Asked Questions

What is the IUPAC name of 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine?
The IUPAC name of 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine (CID 146316045) is 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine.
What is the SMILES notation for 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine?
The canonical SMILES for 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine is Cc1nc2ccc(-c3ccnc(N)c3)nc2n1-c1cccc(CN2CCOCC2)c1.
What is the InChIKey of 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine?
The InChIKey is CAIFTIXFYHSKFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O/c1-16-26-21-6-5-20(18-7-8-25-22(24)14-18)27-23(21)29(16)19-4-2-3-17(13-19)15-28-9-11-30-12-10-28/h2-8,13-14H,9-12,15H2,1H3,(H2,24,25).
What are the key properties of 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine?
4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine has a molecular weight of 400.49 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methyl-3-[3-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridin-5-yl]pyridin-2-amine is sourced from PubChem (CID 146316045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).