1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol

C17H34N2O — CID 114953469

IUPAC1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
SMILESCNCC1(CN(C)CC2(O)CCCC2)CCCC(C)C1
InChIInChI=1S/C17H34N2O/c1-15-7-6-8-16(11-15,12-18-2)13-19(3)14-17(20)9-4-5-10-17/h15,18,20H,4-14H2,1-3H3
InChIKeySFJKAPPHJFWSPT-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.64
Rot. Bonds6

About 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol

1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol (PubChem CID 114953469) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
PubChem CID114953469
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
SMILESCNCC1(CN(C)CC2(O)CCCC2)CCCC(C)C1
InChIInChI=1S/C17H34N2O/c1-15-7-6-8-16(11-15,12-18-2)13-19(3)14-17(20)9-4-5-10-17/h15,18,20H,4-14H2,1-3H3
InChIKeySFJKAPPHJFWSPT-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol with MolForge

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Related Compounds

1-[[methyl-[[4-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
CID 114953505
1-[[methyl-[[1-(propylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol
CID 114953493
N-(2-methoxyethyl)-N-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]propan-2-amine
CID 82953327
3-methyl-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
CID 103358517
1-[[(1-hydroxy-3-methylcyclohexyl)methylamino]methyl]cycloheptan-1-ol
CID 65120782
N-[[3-methyl-1-[[methyl(2-methylsulfanylethyl)amino]methyl]cyclohexyl]methyl]cyclopropanamine
CID 112664702
1-amino-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclohexane-1-carboxamide
CID 114948978
5-[(dimethylamino)methyl]-1-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]pyrrolidin-3-ol
CID 66052929
N,2-dimethyl-N-[[1-(methylaminomethyl)cyclohexyl]methyl]cyclohexan-1-amine
CID 62260857
[3-methyl-1-[[methyl(2-propan-2-yloxyethyl)amino]methyl]cyclohexyl]methanol
CID 81074444
1-[[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl-methylamino]methyl]cyclopentan-1-ol
CID 114953501
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]-1-(oxan-2-yl)methanamine
CID 62256760

Frequently Asked Questions

What is the IUPAC name of 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol (CID 114953469) is 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol is CNCC1(CN(C)CC2(O)CCCC2)CCCC(C)C1.
What is the InChIKey of 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol?
The InChIKey is SFJKAPPHJFWSPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-15-7-6-8-16(11-15,12-18-2)13-19(3)14-17(20)9-4-5-10-17/h15,18,20H,4-14H2,1-3H3.
What are the key properties of 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol?
1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol has a molecular weight of 282.47 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl-[[3-methyl-1-(methylaminomethyl)cyclohexyl]methyl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 114953469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).