ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol

C14H30N2O — CID 178011364

IUPACethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol
SMILESCC.CNC1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C12H24N2O.C2H6/c1-13-10-2-4-11(5-3-10)14-8-6-12(15)7-9-14;1-2/h10-13,15H,2-9H2,1H3;1-2H3
InChIKeyGPQICMZAMIBKOZ-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.00
Rot. Bonds2

About ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol

ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol (PubChem CID 178011364) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol.

Molecular Properties

Compound Nameethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol
PubChem CID178011364
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Nameethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol
SMILESCC.CNC1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C12H24N2O.C2H6/c1-13-10-2-4-11(5-3-10)14-8-6-12(15)7-9-14;1-2/h10-13,15H,2-9H2,1H3;1-2H3
InChIKeyGPQICMZAMIBKOZ-UHFFFAOYSA-N
XLogP2.00
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-methylpiperidin-4-amine;ethane
CID 142484063
N-methyl-4-(4-propan-2-ylazepan-1-yl)cyclohexan-1-amine
CID 114763376
2-[1-[4-(methylamino)cyclohexyl]piperidin-4-yl]oxyethanol
CID 114763538
1-(4-aminocyclohexyl)piperidin-4-ol;methane
CID 146013506
4-(4-tert-butylazepan-1-yl)-N-methylcyclohexan-1-amine
CID 114763379
1-(3-hydroxycyclobutyl)piperidin-4-ol
CID 67281324
N-methyl-1-(1-prop-1-en-2-ylpiperidin-4-yl)piperidin-4-amine
CID 178001600
4-[4-(cyclopropylmethyl)piperazin-1-yl]-N-methylcyclohexan-1-amine
CID 71196303
ethane;N-methyl-1,2,3,5,6,7,8,8a-octahydroindolizin-6-amine
CID 170747754
1-(4-chlorocyclooctyl)piperidin-4-ol
CID 67282956
4-[4-(1-hydroxyethyl)piperidin-1-yl]cyclohexan-1-ol
CID 106839975
N,N-dimethyl-1-[3-(methylamino)cyclopentyl]piperidin-4-amine
CID 79644123

Frequently Asked Questions

What is the IUPAC name of ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol?
The IUPAC name of ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol (CID 178011364) is ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol.
What is the SMILES notation for ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol?
The canonical SMILES for ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol is CC.CNC1CCC(N2CCC(O)CC2)CC1.
What is the InChIKey of ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol?
The InChIKey is GPQICMZAMIBKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.C2H6/c1-13-10-2-4-11(5-3-10)14-8-6-12(15)7-9-14;1-2/h10-13,15H,2-9H2,1H3;1-2H3.
What are the key properties of ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol?
ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol has a molecular weight of 242.41 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-[4-(methylamino)cyclohexyl]piperidin-4-ol is sourced from PubChem (CID 178011364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).