4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine

C18H24N8O — CID 170305522

IUPAC4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
SMILESCc1nnn(C)c1-c1cc(N2CCOCC2C)nc(Nc2ccn[nH]2)c1C
InChIInChI=1S/C18H24N8O/c1-11-10-27-8-7-26(11)16-9-14(17-13(3)22-24-25(17)4)12(2)18(21-16)20-15-5-6-19-23-15/h5-6,9,11H,7-8,10H2,1-4H3,(H2,19,20,21,23)
InChIKeyJVEDROKOFJJCEF-UHFFFAOYSA-N
MW368.45 g/mol
LogP2.19
Rot. Bonds4

About 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine

4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine (PubChem CID 170305522) has the molecular formula C18H24N8O and a molecular weight of 368.45 g/mol. Its IUPAC name is 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
PubChem CID170305522
Molecular FormulaC18H24N8O
Molecular Weight368.45 g/mol
Exact Mass368.21
IUPAC Name4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
SMILESCc1nnn(C)c1-c1cc(N2CCOCC2C)nc(Nc2ccn[nH]2)c1C
InChIInChI=1S/C18H24N8O/c1-11-10-27-8-7-26(11)16-9-14(17-13(3)22-24-25(17)4)12(2)18(21-16)20-15-5-6-19-23-15/h5-6,9,11H,7-8,10H2,1-4H3,(H2,19,20,21,23)
InChIKeyJVEDROKOFJJCEF-UHFFFAOYSA-N
XLogP2.19
TPSA96.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 166928001
(3R)-4-[7-(3,5-dimethyltriazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-methylmorpholine
CID 169035109
3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)-4-(1,3,4-thiadiazol-2-yl)pyridin-2-amine
CID 155585687
3-(iodomethyl)-6-[(3R)-3-methylmorpholin-4-yl]-4-(1-methylsulfonylcyclopropyl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 170361452
(3R)-4-[4-(3,5-dimethyltriazol-4-yl)-5-methyl-7-(1H-pyrrol-2-yl)imidazo[1,5-b]pyridazin-2-yl]-3-methylmorpholine
CID 170219728
3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-4-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 176647633
3-[2-methyl-6-[[6-(3-methylmorpholin-4-yl)pyridazin-3-yl]amino]pyrimidin-4-yl]-N-(1H-pyrazol-5-yl)imidazo[1,2-b]pyridazin-2-amine
CID 67535361
3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-4-[3-methyl-1-piperidin-4-yl-5-(trifluoromethyl)pyrazol-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 176647524
2-[3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-2-(1H-pyrazol-5-ylamino)-4-pyridinyl]-2-methylpropanenitrile
CID 155585674
2-methyl-2-[2-[(3R)-3-methylmorpholin-4-yl]-6-(1H-pyrazol-5-ylamino)-4-pyridinyl]propanenitrile
CID 166928099
(3R)-4-[7-(3,5-dimethyltriazol-4-yl)-3-(5-methylpyrazolidin-3-yl)-[1,2]thiazolo[4,5-b]pyridin-5-yl]-3-methylmorpholine
CID 169429009
methanethiol;2-[3-methanimidoyl-6-(3-methylmorpholin-4-yl)-2-(1H-pyrazol-5-ylamino)-4-pyridinyl]propanenitrile
CID 165400505

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The IUPAC name of 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine (CID 170305522) is 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The canonical SMILES for 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine is Cc1nnn(C)c1-c1cc(N2CCOCC2C)nc(Nc2ccn[nH]2)c1C.
What is the InChIKey of 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The InChIKey is JVEDROKOFJJCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N8O/c1-11-10-27-8-7-26(11)16-9-14(17-13(3)22-24-25(17)4)12(2)18(21-16)20-15-5-6-19-23-15/h5-6,9,11H,7-8,10H2,1-4H3,(H2,19,20,21,23).
What are the key properties of 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine?
4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine has a molecular weight of 368.45 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 170305522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).