1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol

C18H36N2O — CID 106837777

IUPAC1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol
SMILESCCNCC1(CN2CCC(C(C)O)CC2)CCC(C)CC1
InChIInChI=1S/C18H36N2O/c1-4-19-13-18(9-5-15(2)6-10-18)14-20-11-7-17(8-12-20)16(3)21/h15-17,19,21H,4-14H2,1-3H3
InChIKeyHCHPFZJBTSARHK-UHFFFAOYSA-N
MW296.50 g/mol
LogP2.89
Rot. Bonds6

About 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol

1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol (PubChem CID 106837777) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol
PubChem CID106837777
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol
SMILESCCNCC1(CN2CCC(C(C)O)CC2)CCC(C)CC1
InChIInChI=1S/C18H36N2O/c1-4-19-13-18(9-5-15(2)6-10-18)14-20-11-7-17(8-12-20)16(3)21/h15-17,19,21H,4-14H2,1-3H3
InChIKeyHCHPFZJBTSARHK-UHFFFAOYSA-N
XLogP2.89
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol with MolForge

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Related Compounds

1-[1-[[4-(ethylaminomethyl)oxan-4-yl]methyl]piperidin-4-yl]ethanol
CID 106837791
1-[1-[[1-(ethylaminomethyl)cycloheptyl]methyl]pyrrolidin-3-yl]ethanol
CID 115967293
1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]-4-methylpiperidin-3-ol
CID 102967040
1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]-3-methylpiperidin-4-ol
CID 114682040
1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]-4-methylazepan-4-ol
CID 107408681
N-[[1-[(7,7-dimethyl-1,4-thiazepan-4-yl)methyl]-4-methylcyclohexyl]methyl]ethanamine
CID 107459367
1-[1-[[1-[(tert-butylamino)methyl]cyclopentyl]methyl]piperidin-4-yl]ethanol
CID 106837816
4-methyl-1-[[4-methyl-1-(propylaminomethyl)cyclohexyl]methyl]piperidin-4-ol
CID 81107475
1-[1-[[1-(propylaminomethyl)cycloheptyl]methyl]pyrrolidin-3-yl]ethanol
CID 115967239
1-[1-[[1-(aminomethyl)cyclopentyl]methyl]piperidin-4-yl]ethanol
CID 106837787
1-[1-[[1-(aminomethyl)-3-methylcyclohexyl]methyl]piperidin-4-yl]ethanol
CID 106837794
1-[1-[[1-(sulfanylmethyl)cycloheptyl]methyl]piperidin-4-yl]ethanol
CID 106839754

Frequently Asked Questions

What is the IUPAC name of 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol (CID 106837777) is 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol is CCNCC1(CN2CCC(C(C)O)CC2)CCC(C)CC1.
What is the InChIKey of 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol?
The InChIKey is HCHPFZJBTSARHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-19-13-18(9-5-15(2)6-10-18)14-20-11-7-17(8-12-20)16(3)21/h15-17,19,21H,4-14H2,1-3H3.
What are the key properties of 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol?
1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol has a molecular weight of 296.50 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[1-(ethylaminomethyl)-4-methylcyclohexyl]methyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106837777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).