1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol

C18H36N2O — CID 114953487

IUPAC1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol
SMILESCCNC1CCC(C)(C)CC1CN(C)CC1(O)CCCC1
InChIInChI=1S/C18H36N2O/c1-5-19-16-8-11-17(2,3)12-15(16)13-20(4)14-18(21)9-6-7-10-18/h15-16,19,21H,5-14H2,1-4H3
InChIKeyUQQIZMNXBZCBNG-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.03
Rot. Bonds6

About 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol

1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol (PubChem CID 114953487) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol
PubChem CID114953487
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol
SMILESCCNC1CCC(C)(C)CC1CN(C)CC1(O)CCCC1
InChIInChI=1S/C18H36N2O/c1-5-19-16-8-11-17(2,3)12-15(16)13-20(4)14-18(21)9-6-7-10-18/h15-16,19,21H,5-14H2,1-4H3
InChIKeyUQQIZMNXBZCBNG-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol with MolForge

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Related Compounds

4-[[(2-amino-5,5-dimethylcyclohexyl)methyl-methylamino]methyl]oxan-4-ol
CID 114953600
2-[[(1-hydroxycyclopentyl)methyl-methylamino]methyl]cyclohexan-1-ol
CID 113356313
1-[[methyl(pyrrolidin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
CID 106613911
[1-[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl]azepan-2-yl]methanol
CID 116638115
4-[[(2-hydroxy-3,3-dimethylcyclohexyl)methyl-methylamino]methyl]oxan-4-ol
CID 114953741
3-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]-N-ethyloxan-4-amine
CID 103061010
2-(cyclopentylmethoxy)-N-ethyl-4,4-dimethylcyclohexan-1-amine
CID 66321323
1-[[methyl(2-propoxyethyl)amino]methyl]cyclopentan-1-ol
CID 106456276
1-[[2,2-dimethylpropyl(methyl)amino]methyl]cyclopentan-1-ol
CID 65212839
1-[[dodecyl(methyl)amino]methyl]cyclopentan-1-ol
CID 114952592
2-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethylcyclopentan-1-amine
CID 63631296
1-[[3-(ethylamino)propyl-methylamino]methyl]cyclopentan-1-ol
CID 114952474

Frequently Asked Questions

What is the IUPAC name of 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol (CID 114953487) is 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol is CCNC1CCC(C)(C)CC1CN(C)CC1(O)CCCC1.
What is the InChIKey of 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol?
The InChIKey is UQQIZMNXBZCBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-5-19-16-8-11-17(2,3)12-15(16)13-20(4)14-18(21)9-6-7-10-18/h15-16,19,21H,5-14H2,1-4H3.
What are the key properties of 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol?
1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol has a molecular weight of 296.50 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[2-(ethylamino)-5,5-dimethylcyclohexyl]methyl-methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 114953487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).