1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol

C19H21N5O2 — CID 95798865

IUPAC1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol
SMILESCc1cc(-c2cnc(N3CCC(O)CC3)nc2-c2cccnc2C)on1
InChIInChI=1S/C19H21N5O2/c1-12-10-17(26-23-12)16-11-21-19(24-8-5-14(25)6-9-24)22-18(16)15-4-3-7-20-13(15)2/h3-4,7,10-11,14,25H,5-6,8-9H2,1-2H3
InChIKeyRHSZLWQCZLRSFC-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.77
Rot. Bonds3

About 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol

1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol (PubChem CID 95798865) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol
PubChem CID95798865
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol
SMILESCc1cc(-c2cnc(N3CCC(O)CC3)nc2-c2cccnc2C)on1
InChIInChI=1S/C19H21N5O2/c1-12-10-17(26-23-12)16-11-21-19(24-8-5-14(25)6-9-24)22-18(16)15-4-3-7-20-13(15)2/h3-4,7,10-11,14,25H,5-6,8-9H2,1-2H3
InChIKeyRHSZLWQCZLRSFC-UHFFFAOYSA-N
XLogP2.77
TPSA88.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol 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

4-(5-Methyl-3-phenylisoxazol-4-yl)pyrimidin-2-amine
CID 2745721
Trans-4-{[4-(5-Methyl-3-Phenyl-1,2-Oxazol-4-Yl)pyrimidin-2-Yl]amino}cyclohexanol
CID 60138177
2-[4-[2-Ethyl-5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]piperidin-1-yl]-1-morpholin-4-ylethanone
CID 165401423
3-Methyl-5-[4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-2-pyrrolidin-1-ylpyrimidin-5-yl]-1,2-oxazole
CID 45488521
[(3R)-3-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrimidin-2-yl]amino]pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 162645914
(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 1094867
((1S)-2,2,2-Trifluoro-1-(5-{(3R,6R)-6-methyl-1-[(2-pyrimidin-2-ylphenyl)carbonyl]piperidin-3-yl}isoxazol-3-yl)ethanol)
CID 121316005
4-[5-(3-Methyl-1,2-oxazol-5-yl)-4-(1-propylpiperidin-4-yl)pyrimidin-2-yl]morpholine
CID 45488393
2-[4-[2-Methyl-5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]piperidin-1-yl]-1-morpholin-4-ylethanone
CID 16670031
5-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-yl-N-(pyridin-4-ylmethyl)pyrimidin-2-amine
CID 92410671
5-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-yl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
CID 92410672
1-[5-(3-Methyl-1,2-oxazol-5-yl)-4-propan-2-ylpyrimidin-2-yl]piperidin-4-ol
CID 92421452

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol?
The IUPAC name of 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol (CID 95798865) is 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol.
What is the SMILES notation for 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol?
The canonical SMILES for 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol is Cc1cc(-c2cnc(N3CCC(O)CC3)nc2-c2cccnc2C)on1.
What is the InChIKey of 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol?
The InChIKey is RHSZLWQCZLRSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-12-10-17(26-23-12)16-11-21-19(24-8-5-14(25)6-9-24)22-18(16)15-4-3-7-20-13(15)2/h3-4,7,10-11,14,25H,5-6,8-9H2,1-2H3.
What are the key properties of 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol?
1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol has a molecular weight of 351.41 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-methyl-1,2-oxazol-5-yl)-4-(2-methyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-ol is sourced from PubChem (CID 95798865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).