2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine

C18H35NO — CID 64753382

IUPAC2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1CC(C)CC(C)C1OCC1CCCCC1
InChIInChI=1S/C18H35NO/c1-4-10-19-17-12-14(2)11-15(3)18(17)20-13-16-8-6-5-7-9-16/h14-19H,4-13H2,1-3H3
InChIKeyDAYFIHYFESOUSL-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.39
Rot. Bonds6

About 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine

2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine (PubChem CID 64753382) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine
PubChem CID64753382
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1CC(C)CC(C)C1OCC1CCCCC1
InChIInChI=1S/C18H35NO/c1-4-10-19-17-12-14(2)11-15(3)18(17)20-13-16-8-6-5-7-9-16/h14-19H,4-13H2,1-3H3
InChIKeyDAYFIHYFESOUSL-UHFFFAOYSA-N
XLogP4.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-cyclopropylethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 106200648
2-cyclobutyloxy-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64752391
2-heptoxy-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64752974
2-(3-ethylpiperidin-1-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64723017
N-ethyl-3,5-dimethyl-2-propoxycyclohexan-1-amine
CID 64753175
3-(cyclopentylmethoxy)-N-propylcyclopentan-1-amine
CID 79631925
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 115559618
2-N-cyclopentyl-2-N,3,5-trimethyl-1-N-propylcyclohexane-1,2-diamine
CID 64723407
2-ethoxy-N-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64751781
2-N,3,5-trimethyl-2-N-(2-methylcyclohexyl)-1-N-propylcyclohexane-1,2-diamine
CID 64750765
2-(4-methoxypiperidin-1-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64725027
2-(azepan-1-ylmethyl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64736211

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The IUPAC name of 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine (CID 64753382) is 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The canonical SMILES for 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine is CCCNC1CC(C)CC(C)C1OCC1CCCCC1.
What is the InChIKey of 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The InChIKey is DAYFIHYFESOUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-4-10-19-17-12-14(2)11-15(3)18(17)20-13-16-8-6-5-7-9-16/h14-19H,4-13H2,1-3H3.
What are the key properties of 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine?
2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine has a molecular weight of 281.48 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethoxy)-3,5-dimethyl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 64753382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).