(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol

C13H26N2O — CID 125470735

IUPAC(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol
SMILESC[C@@H](O)C1(N2CCN(C)CC2)CCCCC1
InChIInChI=1S/C13H26N2O/c1-12(16)13(6-4-3-5-7-13)15-10-8-14(2)9-11-15/h12,16H,3-11H2,1-2H3/t12-/m1/s1
InChIKeyNGWJMNFIFZLKPC-GFCCVEGCSA-N
MW226.36 g/mol
LogP1.32
Rot. Bonds2

About (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol

(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol (PubChem CID 125470735) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol
PubChem CID125470735
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol
SMILESC[C@@H](O)C1(N2CCN(C)CC2)CCCCC1
InChIInChI=1S/C13H26N2O/c1-12(16)13(6-4-3-5-7-13)15-10-8-14(2)9-11-15/h12,16H,3-11H2,1-2H3/t12-/m1/s1
InChIKeyNGWJMNFIFZLKPC-GFCCVEGCSA-N
XLogP1.32
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol?
The IUPAC name of (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol (CID 125470735) is (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol.
What is the SMILES notation for (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol?
The canonical SMILES for (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol is C[C@@H](O)C1(N2CCN(C)CC2)CCCCC1.
What is the InChIKey of (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol?
The InChIKey is NGWJMNFIFZLKPC-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12(16)13(6-4-3-5-7-13)15-10-8-14(2)9-11-15/h12,16H,3-11H2,1-2H3/t12-/m1/s1.
What are the key properties of (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol?
(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol has a molecular weight of 226.36 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol is sourced from PubChem (CID 125470735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).