N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine

C24H26N6O — CID 178129694

IUPACN-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine
SMILESC[C@@H]1CN(c2cccc(Nc3cc(-c4ccc5c(cnn5C)n4)ccn3)c2)C[C@H](C)O1
InChIInChI=1S/C24H26N6O/c1-16-14-30(15-17(2)31-16)20-6-4-5-19(12-20)27-24-11-18(9-10-25-24)21-7-8-23-22(28-21)13-26-29(23)3/h4-13,16-17H,14-15H2,1-3H3,(H,25,27)/t16-,17+
InChIKeyPNVKYRMAGQAGNZ-CALCHBBNSA-N
MW414.51 g/mol
LogP4.39
Rot. Bonds4

About N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine

N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine (PubChem CID 178129694) has the molecular formula C24H26N6O and a molecular weight of 414.51 g/mol. Its IUPAC name is N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine
PubChem CID178129694
Molecular FormulaC24H26N6O
Molecular Weight414.51 g/mol
Exact Mass414.22
IUPAC NameN-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine
SMILESC[C@@H]1CN(c2cccc(Nc3cc(-c4ccc5c(cnn5C)n4)ccn3)c2)C[C@H](C)O1
InChIInChI=1S/C24H26N6O/c1-16-14-30(15-17(2)31-16)20-6-4-5-19(12-20)27-24-11-18(9-10-25-24)21-7-8-23-22(28-21)13-26-29(23)3/h4-13,16-17H,14-15H2,1-3H3,(H,25,27)/t16-,17+
InChIKeyPNVKYRMAGQAGNZ-CALCHBBNSA-N
XLogP4.39
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5-fluoro-N-[4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)-2-pyridinyl]pyridin-4-amine
CID 178129679
5-[2-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]anilino]-4-pyridinyl]-N,N,1-trimethylindazol-3-amine
CID 178129721
N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-3-(2-methylpyrazolo[4,3-b]pyridin-5-yl)aniline
CID 178129755
N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]quinoxalin-2-amine
CID 99788867
4-[2-(deuteriomethyl)indazol-5-yl]-N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-pyridinyl]pyridin-2-amine
CID 178129654
6-(2,6-dimethylmorpholin-4-yl)-N-(3-methylphenyl)pyrimidin-4-amine
CID 67695006
4-(5-cyclopropyl-4-pyrrolidin-1-ylpyrido[3,4-d]pyrimidin-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]pyridin-2-amine
CID 90098755
(3S,4S)-1-[5-cyclopropyl-2-[2-[3-(4-methylpiperazin-1-yl)anilino]-4-pyridinyl]pyrido[3,4-d]pyrimidin-4-yl]piperidine-3,4-diol
CID 90099126
2,6-dimethyl-4-quinolin-3-ylmorpholine
CID 135233182
5-N-[4-(2,6-dimethylmorpholin-4-yl)-2-methylphenyl]-1-methylbenzimidazole-2,5-diamine
CID 167300182
5-N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-1-methylbenzimidazole-2,5-diamine
CID 167300395
N-[4-[2-(difluoromethyl)indazol-5-yl]-2-pyridinyl]-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-amine
CID 178129764

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine?
The IUPAC name of N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine (CID 178129694) is N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine.
What is the SMILES notation for N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine?
The canonical SMILES for N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine is C[C@@H]1CN(c2cccc(Nc3cc(-c4ccc5c(cnn5C)n4)ccn3)c2)C[C@H](C)O1.
What is the InChIKey of N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine?
The InChIKey is PNVKYRMAGQAGNZ-CALCHBBNSA-N. The full InChI is InChI=1S/C24H26N6O/c1-16-14-30(15-17(2)31-16)20-6-4-5-19(12-20)27-24-11-18(9-10-25-24)21-7-8-23-22(28-21)13-26-29(23)3/h4-13,16-17H,14-15H2,1-3H3,(H,25,27)/t16-,17+.
What are the key properties of N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine?
N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine has a molecular weight of 414.51 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(1-methylpyrazolo[4,5-b]pyridin-5-yl)pyridin-2-amine is sourced from PubChem (CID 178129694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).