1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine

C15H31NO — CID 105156121

IUPAC1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine
SMILESCCC1CCCC(C(CCC(C)OC)NC)C1
InChIInChI=1S/C15H31NO/c1-5-13-7-6-8-14(11-13)15(16-3)10-9-12(2)17-4/h12-16H,5-11H2,1-4H3
InChIKeyAKEPFHXFBQLCJG-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.61
Rot. Bonds7

About 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine

1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine (PubChem CID 105156121) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine
PubChem CID105156121
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine
SMILESCCC1CCCC(C(CCC(C)OC)NC)C1
InChIInChI=1S/C15H31NO/c1-5-13-7-6-8-14(11-13)15(16-3)10-9-12(2)17-4/h12-16H,5-11H2,1-4H3
InChIKeyAKEPFHXFBQLCJG-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-ethylcyclohexyl)-4-methoxy-N-propylpentan-1-amine
CID 105156081
1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
CID 65414544
1-(3-ethylcyclohexyl)-N-methylpent-3-yn-1-amine
CID 65415557
1-[3-(2-cycloheptylethyl)cyclohexyl]-N-methylbutan-1-amine
CID 170003941
1-(3-ethylcyclohexyl)-N-propan-2-ylpentan-1-amine
CID 79411539
1-(3-ethylcyclohexyl)-4-methoxy-4-methyl-N-propylpentan-1-amine
CID 103035736
1-cyclopentyl-N-ethyl-5-methoxyhexan-2-amine
CID 105138937
3-ethoxy-N-ethyl-1-(3-ethylcyclohexyl)propan-1-amine
CID 105156239
1-(4-ethylcyclohexyl)-4-methoxy-N-propylpentan-1-amine
CID 105155222
1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 65394157
1-(3-ethylcyclohexyl)-2,2-dimethoxyethanamine
CID 79493446
1-cyclobutyl-5-methoxyhexan-2-amine
CID 105151744

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine?
The IUPAC name of 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine (CID 105156121) is 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine is CCC1CCCC(C(CCC(C)OC)NC)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine?
The InChIKey is AKEPFHXFBQLCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-5-13-7-6-8-14(11-13)15(16-3)10-9-12(2)17-4/h12-16H,5-11H2,1-4H3.
What are the key properties of 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine?
1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-4-methoxy-N-methylpentan-1-amine is sourced from PubChem (CID 105156121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).