4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine

C18H36N2O — CID 43098474

IUPAC4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine
SMILESCCC1CCC(NCC(CC(C)C)N2CCOCC2)CC1
InChIInChI=1S/C18H36N2O/c1-4-16-5-7-17(8-6-16)19-14-18(13-15(2)3)20-9-11-21-12-10-20/h15-19H,4-14H2,1-3H3
InChIKeyXSVGLOLIBATMBC-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.29
Rot. Bonds7

About 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine

4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine (PubChem CID 43098474) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine
PubChem CID43098474
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine
SMILESCCC1CCC(NCC(CC(C)C)N2CCOCC2)CC1
InChIInChI=1S/C18H36N2O/c1-4-16-5-7-17(8-6-16)19-14-18(13-15(2)3)20-9-11-21-12-10-20/h15-19H,4-14H2,1-3H3
InChIKeyXSVGLOLIBATMBC-UHFFFAOYSA-N
XLogP3.29
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine (CID 43098474) is 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine is CCC1CCC(NCC(CC(C)C)N2CCOCC2)CC1.
What is the InChIKey of 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine?
The InChIKey is XSVGLOLIBATMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-16-5-7-17(8-6-16)19-14-18(13-15(2)3)20-9-11-21-12-10-20/h15-19H,4-14H2,1-3H3.
What are the key properties of 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine?
4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine has a molecular weight of 296.50 g/mol, XLogP of 3.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-methyl-2-morpholin-4-ylpentyl)cyclohexan-1-amine is sourced from PubChem (CID 43098474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).