1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol

C14H28N2O — CID 65208757

IUPAC1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
SMILESCCC1CN(CC2(O)CCCCC2)CCN1C
InChIInChI=1S/C14H28N2O/c1-3-13-11-16(10-9-15(13)2)12-14(17)7-5-4-6-8-14/h13,17H,3-12H2,1-2H3
InChIKeyOMIQNVOUVGZSAI-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.71
Rot. Bonds3

About 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol

1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol (PubChem CID 65208757) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
PubChem CID65208757
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
SMILESCCC1CN(CC2(O)CCCCC2)CCN1C
InChIInChI=1S/C14H28N2O/c1-3-13-11-16(10-9-15(13)2)12-14(17)7-5-4-6-8-14/h13,17H,3-12H2,1-2H3
InChIKeyOMIQNVOUVGZSAI-UHFFFAOYSA-N
XLogP1.71
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclopentyl]methyl]propan-2-amine
CID 63619386
1-[(4-ethylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 60723383
1-(azetidin-1-ylmethyl)cyclohexan-1-ol
CID 84731810
2-[1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclopropyl]acetonitrile
CID 65495085
1-[[(3aR,6aS)-2,3a-dimethyl-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]methyl]cyclohexan-1-ol
CID 129149585
1-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]cyclohexan-1-ol
CID 115277735
1-[[(3aR,6aS)-2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]methyl]cyclohexan-1-ol
CID 118534899
4-[2-(1,3-dioxan-2-yl)ethyl]-2-ethyl-1-methylpiperazine
CID 66474133
4-(3-ethyl-4-methylpiperazin-1-yl)-2-methylbutan-2-ol
CID 79360842
4-[(3,4-dimethylpiperazin-1-yl)methyl]piperidin-4-ol
CID 63608638
1-[[3-(1-aminoethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
CID 103976483
1-[[3-(dimethylamino)piperidin-1-yl]methyl]cyclohexan-1-ol
CID 63950406

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol (CID 65208757) is 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol is CCC1CN(CC2(O)CCCCC2)CCN1C.
What is the InChIKey of 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
The InChIKey is OMIQNVOUVGZSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-13-11-16(10-9-15(13)2)12-14(17)7-5-4-6-8-14/h13,17H,3-12H2,1-2H3.
What are the key properties of 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol?
1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethyl-4-methylpiperazin-1-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 65208757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).