N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine

C25H33N5O2 — CID 125005462

IUPACN-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCOc1cc(C)c(CN2CCO[C@@H](c3cccc(Nc4cc(C)n(C)n4)n3)C2)c(C)c1C
InChIInChI=1S/C25H33N5O2/c1-16-12-22(31-6)19(4)18(3)20(16)14-30-10-11-32-23(15-30)21-8-7-9-24(26-21)27-25-13-17(2)29(5)28-25/h7-9,12-13,23H,10-11,14-15H2,1-6H3,(H,26,27,28)/t23-/m1/s1
InChIKeyTZMYHYOYDYVTMI-HSZRJFAPSA-N
MW435.57 g/mol
LogP4.37
Rot. Bonds6

About N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine

N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine (PubChem CID 125005462) has the molecular formula C25H33N5O2 and a molecular weight of 435.57 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine
PubChem CID125005462
Molecular FormulaC25H33N5O2
Molecular Weight435.57 g/mol
Exact Mass435.26
IUPAC NameN-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCOc1cc(C)c(CN2CCO[C@@H](c3cccc(Nc4cc(C)n(C)n4)n3)C2)c(C)c1C
InChIInChI=1S/C25H33N5O2/c1-16-12-22(31-6)19(4)18(3)20(16)14-30-10-11-32-23(15-30)21-8-7-9-24(26-21)27-25-13-17(2)29(5)28-25/h7-9,12-13,23H,10-11,14-15H2,1-6H3,(H,26,27,28)/t23-/m1/s1
InChIKeyTZMYHYOYDYVTMI-HSZRJFAPSA-N
XLogP4.37
TPSA64.44 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.57
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(1,5-dimethylpyrazol-3-yl)-6-[(2S)-4-[(6-methoxy-1-methylindol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125023234
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-(quinolin-4-ylmethyl)morpholin-2-yl]pyridin-2-amine
CID 124965241
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-(quinolin-6-ylmethyl)morpholin-2-yl]pyridin-2-amine
CID 124953524
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(6-methoxy-2H-chromen-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124975870
N-(1,5-dimethylpyrazol-3-yl)-6-[4-[(6-methoxy-2H-chromen-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 127249768
[5-[[(2R)-2-[6-[(1,5-dimethylpyrazol-3-yl)amino]-2-pyridinyl]morpholin-4-yl]methyl]-2-ethoxyphenyl]methanol
CID 124988259
3-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 127250616
3-[6-[(2S)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124940397
5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]-3-pyridinyl]pyridin-2-amine
CID 127250428
6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 110112505
6-[(2S)-4-cyclopentylsulfonylmorpholin-2-yl]-N-(1,5-dimethylpyrazol-3-yl)pyridin-2-amine
CID 124970812
6-methyl-N-[6-[(2R)-4-[(2-methylpyrazol-3-yl)methyl]morpholin-2-yl]-2-pyridinyl]pyridin-2-amine
CID 124977186

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine?
The IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine (CID 125005462) is N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine.
What is the SMILES notation for N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine?
The canonical SMILES for N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine is COc1cc(C)c(CN2CCO[C@@H](c3cccc(Nc4cc(C)n(C)n4)n3)C2)c(C)c1C.
What is the InChIKey of N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine?
The InChIKey is TZMYHYOYDYVTMI-HSZRJFAPSA-N. The full InChI is InChI=1S/C25H33N5O2/c1-16-12-22(31-6)19(4)18(3)20(16)14-30-10-11-32-23(15-30)21-8-7-9-24(26-21)27-25-13-17(2)29(5)28-25/h7-9,12-13,23H,10-11,14-15H2,1-6H3,(H,26,27,28)/t23-/m1/s1.
What are the key properties of N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine?
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine has a molecular weight of 435.57 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine is sourced from PubChem (CID 125005462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).