4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol

C11H16N2O — CID 116901966

IUPAC4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol
SMILESCc1ccnc(C2CCC(O)CC2)n1
InChIInChI=1S/C11H16N2O/c1-8-6-7-12-11(13-8)9-2-4-10(14)5-3-9/h6-7,9-10,14H,2-5H2,1H3
InChIKeySXYIPQRNJZMVDG-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.80
Rot. Bonds1

About 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol

4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol (PubChem CID 116901966) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol
PubChem CID116901966
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol
SMILESCc1ccnc(C2CCC(O)CC2)n1
InChIInChI=1S/C11H16N2O/c1-8-6-7-12-11(13-8)9-2-4-10(14)5-3-9/h6-7,9-10,14H,2-5H2,1H3
InChIKeySXYIPQRNJZMVDG-UHFFFAOYSA-N
XLogP1.80
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(4-methylpyrimidin-2-yl)cyclohexan-1-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

2-cyclopropyl-4-methylpyrimidine;formic acid
CID 165132311
4-pyrimidin-2-ylcyclohexan-1-ol
CID 19863149
4-methyl-2-[1-(2-methylpropyl)piperidin-4-yl]pyrimidine
CID 95821351
2-(azetidin-3-yl)-4-methylpyrimidine;dihydrochloride
CID 71298998
4-(2-methylpyrimidin-4-yl)cyclohexan-1-ol
CID 139330455
2-[(3R)-3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]acetic acid
CID 124954393
4-methyl-2-(1-methylpiperidin-3-yl)pyrimidine
CID 122609712
4-methyl-2-[(3R)-1-(oxan-4-yl)pyrrolidin-3-yl]pyrimidine
CID 124641598
(5-methylpyrazin-2-yl)-[3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methanone
CID 175652427
4-methyl-2-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidine
CID 138038763
4-methyl-2-[(3R)-1-pyrimidin-4-ylpyrrolidin-3-yl]pyrimidine
CID 95841795
4-methyl-2-[(3S)-1-pyrimidin-4-ylpyrrolidin-3-yl]pyrimidine
CID 95841796

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol?
The IUPAC name of 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol (CID 116901966) is 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol is Cc1ccnc(C2CCC(O)CC2)n1.
What is the InChIKey of 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol?
The InChIKey is SXYIPQRNJZMVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-6-7-12-11(13-8)9-2-4-10(14)5-3-9/h6-7,9-10,14H,2-5H2,1H3.
What are the key properties of 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol?
4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol has a molecular weight of 192.26 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpyrimidin-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 116901966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).