4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol

C14H23N3O — CID 106130133

IUPAC4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCc1cc(NCC2CCC(O)CC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-12-8-14(17-10(2)16-12)15-9-11-4-6-13(18)7-5-11/h8,11,13,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeyVMTRANGTRLJPAI-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.31
Rot. Bonds4

About 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol

4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 106130133) 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]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
PubChem CID106130133
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCCc1cc(NCC2CCC(O)CC2)nc(C)n1
InChIInChI=1S/C14H23N3O/c1-3-12-8-14(17-10(2)16-12)15-9-11-4-6-13(18)7-5-11/h8,11,13,18H,3-7,9H2,1-2H3,(H,15,16,17)
InChIKeyVMTRANGTRLJPAI-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]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

4-[[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106138816
6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563627
1-[4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]-2,2,2-trifluoroethanone
CID 133472278
6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107419264
N-(cyclopropylmethyl)-2,6-dimethylpyrimidin-4-amine
CID 60732015
4-[[(6-chloro-2-ethylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 114148553
N,6-diethyl-2-methylpyrimidin-4-amine
CID 62191281
4-[[[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 106138643
6-ethyl-N-[[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methyl]-2-methylpyrimidin-4-amine
CID 133460671
[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 133472420
N-(cyclopropylmethyl)-4-ethyl-6-methylpyrimidin-2-amine
CID 131153777
4-[[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 106138505

Frequently Asked Questions

What is the IUPAC name of 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol (CID 106130133) is 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol is CCc1cc(NCC2CCC(O)CC2)nc(C)n1.
What is the InChIKey of 4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is VMTRANGTRLJPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-12-8-14(17-10(2)16-12)15-9-11-4-6-13(18)7-5-11/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]methyl]cyclohexan-1-ol?
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol 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]methyl]cyclohexan-1-ol is sourced from PubChem (CID 106130133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).