[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol

C14H23N3O — CID 133472420

IUPAC[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
SMILESCCc1cc(NC2CCC(CO)CC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-12-8-14(16-10(2)15-12)17-13-6-4-11(9-18)5-7-13/h8,11,13,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeyJSCXNXHYXDDCQK-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.31
Rot. Bonds4

About [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol

[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol (PubChem CID 133472420) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
PubChem CID133472420
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
SMILESCCc1cc(NC2CCC(CO)CC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-12-8-14(16-10(2)15-12)17-13-6-4-11(9-18)5-7-13/h8,11,13,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeyJSCXNXHYXDDCQK-UHFFFAOYSA-N
XLogP2.31
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol with MolForge

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Related Compounds

4-N-(6-ethyl-2-methylpyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine
CID 79110713
2-[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]piperidin-1-yl]cyclohexan-1-ol
CID 133472742
6-ethyl-2-methyl-N-[1-(2-methylprop-2-enyl)piperidin-4-yl]pyrimidin-4-amine
CID 133460514
[2-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cycloheptyl]methanol
CID 133472380
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130133
3-N-(6-ethyl-2-methylpyrimidin-4-yl)-1-N,1-N-dimethylcyclohexane-1,3-diamine
CID 133461679
6-[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]oxypyridine-3-carbonitrile
CID 133462268
3-cyclohexyl-3-[(6-ethyl-2-methylpyrimidin-4-yl)amino]propan-1-ol
CID 133460886
N-(6-ethyl-2-methylpyrimidin-4-yl)-4,5,6,7-tetrahydro-1H-indazol-5-amine
CID 133460777
2-chloro-N-cyclopentyl-6-ethylpyrimidin-4-amine
CID 82460547
6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563627
6-ethoxy-2-methyl-N-(4-propylcyclohexyl)pyrimidin-4-amine
CID 66324652

Frequently Asked Questions

What is the IUPAC name of [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol?
The IUPAC name of [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol (CID 133472420) is [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol is CCc1cc(NC2CCC(CO)CC2)nc(C)n1.
What is the InChIKey of [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol?
The InChIKey is JSCXNXHYXDDCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-12-8-14(16-10(2)15-12)17-13-6-4-11(9-18)5-7-13/h8,11,13,18H,3-7,9H2,1-2H3,(H,15,16,17).
What are the key properties of [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol?
[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol has a molecular weight of 249.36 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 133472420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).