1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine

C14H29NO — CID 105135620

IUPAC1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine
SMILESCCOCCCC(CC1CCCCC1)NC
InChIInChI=1S/C14H29NO/c1-3-16-11-7-10-14(15-2)12-13-8-5-4-6-9-13/h13-15H,3-12H2,1-2H3
InChIKeyFJFGURYUINDQIP-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.36
Rot. Bonds8

About 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine

1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine (PubChem CID 105135620) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine
PubChem CID105135620
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine
SMILESCCOCCCC(CC1CCCCC1)NC
InChIInChI=1S/C14H29NO/c1-3-16-11-7-10-14(15-2)12-13-8-5-4-6-9-13/h13-15H,3-12H2,1-2H3
InChIKeyFJFGURYUINDQIP-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclobutyl-5-ethoxy-N-methylpentan-2-amine
CID 105151604
(1-cyclopentyl-5-ethoxypentan-2-yl)hydrazine
CID 105299060
1-cycloheptyl-N-methylhexan-2-amine
CID 115832695
(1-cyclobutyl-5-ethoxypentan-2-yl)hydrazine
CID 105310062
1-cyclohexyl-N-methylheptan-2-amine
CID 115836969
1-cyclopentyl-5-ethoxy-N-propylpentan-2-amine
CID 105139073
1-cycloheptyl-N,6,6-trimethylheptan-2-amine
CID 114211051
1-cyclohexyl-N-methylbutan-2-amine
CID 62601734
1-cyclobutyl-N-methylnonan-2-amine
CID 115863864
1-cycloheptyl-N-methyl-5-methylsulfonylpentan-2-amine
CID 115820359
(1-cyclopropyl-4-ethoxybutan-2-yl)hydrazine
CID 105311138
1-cyclopentyl-N-methylhept-6-yn-2-amine
CID 105034139

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine?
The IUPAC name of 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine (CID 105135620) is 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine.
What is the SMILES notation for 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine?
The canonical SMILES for 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine is CCOCCCC(CC1CCCCC1)NC.
What is the InChIKey of 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine?
The InChIKey is FJFGURYUINDQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-16-11-7-10-14(15-2)12-13-8-5-4-6-9-13/h13-15H,3-12H2,1-2H3.
What are the key properties of 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine?
1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine has a molecular weight of 227.39 g/mol, XLogP of 3.36, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-5-ethoxy-N-methylpentan-2-amine is sourced from PubChem (CID 105135620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).