[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol

C17H35N3O — CID 105418636

IUPAC[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N(C)CC2(N(C)C)CCC2)C1
InChIInChI=1S/C17H35N3O/c1-5-18-16(14-21)9-6-8-15(12-16)20(4)13-17(19(2)3)10-7-11-17/h15,18,21H,5-14H2,1-4H3
InChIKeyNAUSLTYUXMVXMX-UHFFFAOYSA-N
MW297.49 g/mol
LogP1.69
Rot. Bonds7

About [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol

[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol (PubChem CID 105418636) has the molecular formula C17H35N3O and a molecular weight of 297.49 g/mol. Its IUPAC name is [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol
PubChem CID105418636
Molecular FormulaC17H35N3O
Molecular Weight297.49 g/mol
Exact Mass297.28
IUPAC Name[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol
SMILESCCNC1(CO)CCCC(N(C)CC2(N(C)C)CCC2)C1
InChIInChI=1S/C17H35N3O/c1-5-18-16(14-21)9-6-8-15(12-16)20(4)13-17(19(2)3)10-7-11-17/h15,18,21H,5-14H2,1-4H3
InChIKeyNAUSLTYUXMVXMX-UHFFFAOYSA-N
XLogP1.69
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.49
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol with MolForge

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Related Compounds

[1-(ethylamino)-3-[methyl(pentan-3-yl)amino]cyclohexyl]methanol
CID 79641023
[1-(ethylamino)-3-[methyl(pentan-2-yl)amino]cyclohexyl]methanol
CID 79640702
[1-(ethylamino)-3-[methyl(oxan-4-yl)amino]cyclohexyl]methanol
CID 79641104
[1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclohexyl]methanol
CID 79640639
[1-(ethylamino)-3-[(1-ethylpiperidin-4-yl)-methylamino]cyclohexyl]methanol
CID 79635686
[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655884
[3-[butyl(ethyl)amino]-1-(ethylamino)cyclohexyl]methanol
CID 79633810
methyl 1-amino-3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]cyclohexane-1-carboxylate
CID 105416924
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635385
[3-[butyl(methyl)amino]-1-(propylamino)cyclohexyl]methanol
CID 79634231
[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
CID 79656682

Frequently Asked Questions

What is the IUPAC name of [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol?
The IUPAC name of [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol (CID 105418636) is [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol.
What is the SMILES notation for [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol?
The canonical SMILES for [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol is CCNC1(CO)CCCC(N(C)CC2(N(C)C)CCC2)C1.
What is the InChIKey of [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol?
The InChIKey is NAUSLTYUXMVXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O/c1-5-18-16(14-21)9-6-8-15(12-16)20(4)13-17(19(2)3)10-7-11-17/h15,18,21H,5-14H2,1-4H3.
What are the key properties of [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol?
[3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol has a molecular weight of 297.49 g/mol, XLogP of 1.69, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-1-(ethylamino)cyclohexyl]methanol is sourced from PubChem (CID 105418636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).