4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine

C18H23N7O — CID 166928001

IUPAC4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
SMILESCc1cnn(C)c1-c1cc(Nc2ccn[nH]2)nc(N2CCOC[C@H]2C)c1
InChIInChI=1S/C18H23N7O/c1-12-10-20-24(3)18(12)14-8-16(21-15-4-5-19-23-15)22-17(9-14)25-6-7-26-11-13(25)2/h4-5,8-10,13H,6-7,11H2,1-3H3,(H2,19,21,22,23)/t13-/m1/s1
InChIKeyVKSLLTQOYUFZCS-CYBMUJFWSA-N
MW353.43 g/mol
LogP2.48
Rot. Bonds4

About 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine

4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine (PubChem CID 166928001) has the molecular formula C18H23N7O and a molecular weight of 353.43 g/mol. Its IUPAC name is 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
PubChem CID166928001
Molecular FormulaC18H23N7O
Molecular Weight353.43 g/mol
Exact Mass353.20
IUPAC Name4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
SMILESCc1cnn(C)c1-c1cc(Nc2ccn[nH]2)nc(N2CCOC[C@H]2C)c1
InChIInChI=1S/C18H23N7O/c1-12-10-20-24(3)18(12)14-8-16(21-15-4-5-19-23-15)22-17(9-14)25-6-7-26-11-13(25)2/h4-5,8-10,13H,6-7,11H2,1-3H3,(H2,19,21,22,23)/t13-/m1/s1
InChIKeyVKSLLTQOYUFZCS-CYBMUJFWSA-N
XLogP2.48
TPSA83.89 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-methyl-2-[2-[(3R)-3-methylmorpholin-4-yl]-6-(1H-pyrazol-5-ylamino)-4-pyridinyl]propanenitrile
CID 166928099
tert-butyl 5-[[4-(1,4-dimethylpyrazol-5-yl)-6-(3-methylmorpholin-4-yl)-2-pyridinyl]amino]-3-methylpyrazole-1-carboxylate
CID 166928090
1-[2-[(3R)-3-methylmorpholin-4-yl]-6-(1H-pyrazol-5-ylamino)-4-pyridinyl]cyclopentane-1-carbonitrile
CID 166927935
6-[(3R)-3-methylmorpholin-4-yl]-4-(4-methylsulfonyloxan-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 166928055
4-(3,5-dimethyltriazol-4-yl)-3-methyl-6-(3-methylmorpholin-4-yl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 170305522
4-[2-chloro-6-(1,4-dimethylpyrazol-5-yl)pyrimidin-4-yl]-3-methylmorpholine
CID 139406180
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
4-[6-(1,4-dimethylpyrazol-5-yl)-2-(1H-indol-4-yl)pyrimidin-4-yl]-3-methylmorpholine
CID 139406033
2-methyl-6-N-(2-morpholin-4-ylethyl)-4-N-(1H-pyrazol-5-yl)pyrimidine-4,6-diamine
CID 142845392
4-[3-(dimethylamino)prop-1-ynyl]-3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 176647369
3-(iodomethyl)-6-[(3R)-3-methylmorpholin-4-yl]-4-(1-methylsulfonylcyclopropyl)-N-(1H-pyrazol-5-yl)pyridin-2-amine
CID 170361452
2-[3-methanimidoyl-6-[(3R)-3-methylmorpholin-4-yl]-2-(1H-pyrazol-5-ylamino)-4-pyridinyl]-2-methylpropanenitrile
CID 155585674

Frequently Asked Questions

What is the IUPAC name of 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The IUPAC name of 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine (CID 166928001) is 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The canonical SMILES for 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine is Cc1cnn(C)c1-c1cc(Nc2ccn[nH]2)nc(N2CCOC[C@H]2C)c1.
What is the InChIKey of 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine?
The InChIKey is VKSLLTQOYUFZCS-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H23N7O/c1-12-10-20-24(3)18(12)14-8-16(21-15-4-5-19-23-15)22-17(9-14)25-6-7-26-11-13(25)2/h4-5,8-10,13H,6-7,11H2,1-3H3,(H2,19,21,22,23)/t13-/m1/s1.
What are the key properties of 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine?
4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine has a molecular weight of 353.43 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,4-dimethylpyrazol-5-yl)-6-[(3R)-3-methylmorpholin-4-yl]-N-(1H-pyrazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 166928001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).