[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol

C24H27N3O — CID 3228642

IUPAC[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol
SMILESCc1cc(N2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)nc(C)n1
InChIInChI=1S/C24H27N3O/c1-18-17-23(26-19(2)25-18)27-15-13-22(14-16-27)24(28,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,17,22,28H,13-16H2,1-2H3
InChIKeyUDINWFLUBMNJTK-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.25
Rot. Bonds4

About [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol

[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol (PubChem CID 3228642) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol.

Molecular Properties

Compound Name[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol
PubChem CID3228642
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC Name[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol
SMILESCc1cc(N2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)nc(C)n1
InChIInChI=1S/C24H27N3O/c1-18-17-23(26-19(2)25-18)27-15-13-22(14-16-27)24(28,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,17,22,28H,13-16H2,1-2H3
InChIKeyUDINWFLUBMNJTK-UHFFFAOYSA-N
XLogP4.25
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-({[4-(2,4-Diamino-6-ethylpyrimidin-5-yl)phenyl]amino}methyl)phenyl]ethan-1-ol
CID 11523411
(1R)-1-phenyl-2-[[6-(4-propan-2-ylphenyl)pyrimidin-4-yl]amino]ethanol
CID 44204626
6-(4-hydroxy-4-phenylpiperidin-1-yl)-1-methyl-4-(pyrimidin-4-yl)pyridin-2(1H)-one
CID 46871676
3-(4-Fluorophenyl)-8-(6-methyl-2-phenylpyrimidin-4-yl)-8-azabicyclo[3.2.1]octan-3-ol
CID 653235
2-(4-Methyl-6-(4-phenylpiperazin-1-yl)pyrimidin-2-yl)phenol
CID 947317
[6-(Cyclopropylmethyl-propyl-amino)-2-methyl-pyrimidin-4-yl]-(2,4,6-trimethyl-phenyl)-methanol
CID 44392801
[6-(Cyclopropylmethyl-propyl-amino)-2-methyl-pyrimidin-4-yl]-(2,4,6-triethyl-phenyl)-methanol
CID 44392802
4-[2-[[2-(2,2-Diphenylethylamino)-6-methylpyrimidin-4-yl]amino]ethyl]phenol
CID 44532334
2-(4-(4-Ethylpiperazin-1-yl)-6-methylpyrimidin-2-yl)phenol
CID 747896
8-(4-Methylpyrimidin-2-yl)-3-phenyl-8-azabicyclo[3.2.1]octan-3-ol
CID 3228658
2-[4-Methyl-6-(2-methylpiperidin-1-yl)pyrimidin-2-yl]phenol
CID 4262785
4-(4-Fluorophenyl)-1-(4-methylpyrimidin-2-YL)piperidin-4-OL
CID 72851395

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol?
The IUPAC name of [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol (CID 3228642) is [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol.
What is the SMILES notation for [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol?
The canonical SMILES for [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol is Cc1cc(N2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)nc(C)n1.
What is the InChIKey of [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol?
The InChIKey is UDINWFLUBMNJTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-18-17-23(26-19(2)25-18)27-15-13-22(14-16-27)24(28,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,17,22,28H,13-16H2,1-2H3.
What are the key properties of [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol?
[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol has a molecular weight of 373.50 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-diphenylmethanol is sourced from PubChem (CID 3228642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).