4-(cyclohexylmethoxy)-N-ethylpentan-1-amine

C14H29NO — CID 62485288

IUPAC4-(cyclohexylmethoxy)-N-ethylpentan-1-amine
SMILESCCNCCCC(C)OCC1CCCCC1
InChIInChI=1S/C14H29NO/c1-3-15-11-7-8-13(2)16-12-14-9-5-4-6-10-14/h13-15H,3-12H2,1-2H3
InChIKeyIZESRJGWTLLFBA-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.36
Rot. Bonds8

About 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine

4-(cyclohexylmethoxy)-N-ethylpentan-1-amine (PubChem CID 62485288) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine.

Molecular Properties

Compound Name4-(cyclohexylmethoxy)-N-ethylpentan-1-amine
PubChem CID62485288
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-(cyclohexylmethoxy)-N-ethylpentan-1-amine
SMILESCCNCCCC(C)OCC1CCCCC1
InChIInChI=1S/C14H29NO/c1-3-15-11-7-8-13(2)16-12-14-9-5-4-6-10-14/h13-15H,3-12H2,1-2H3
InChIKeyIZESRJGWTLLFBA-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

3-(cyclohexylmethoxy)-N-ethylbutan-1-amine
CID 114999307
N-[2-(cyclohexylmethoxy)propyl]butan-1-amine
CID 62585334
N-ethyl-4-[(1-methylpiperidin-2-yl)methoxy]pentan-1-amine
CID 65467693
2-(cycloheptylmethoxy)-N-methylpropan-1-amine
CID 165349469
N-(cyclohexylmethyl)-4-methylpentan-1-amine
CID 60743779
N-(cyclohexylmethyl)-2-octan-2-yloxyethanamine
CID 55194759
N-ethyl-4-prop-2-enoxypentan-1-amine
CID 62442488
4-[(1-methylpiperidin-2-yl)methoxy]-N-propylpentan-1-amine
CID 65469240
N-[[5-(octan-2-yloxymethyl)oxolan-2-yl]methyl]ethanamine
CID 62456442
4-chloro-N-(cyclohexylmethyl)pentan-1-amine
CID 106122000
4-cyclopentyl-N-ethyl-3-methylbutan-1-amine
CID 81019020
N-ethyl-4-[3-(2-methoxyethoxy)propoxy]pentan-1-amine
CID 103406214

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine?
The IUPAC name of 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine (CID 62485288) is 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine.
What is the SMILES notation for 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine?
The canonical SMILES for 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine is CCNCCCC(C)OCC1CCCCC1.
What is the InChIKey of 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine?
The InChIKey is IZESRJGWTLLFBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-15-11-7-8-13(2)16-12-14-9-5-4-6-10-14/h13-15H,3-12H2,1-2H3.
What are the key properties of 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine?
4-(cyclohexylmethoxy)-N-ethylpentan-1-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 4-(cyclohexylmethoxy)-N-ethylpentan-1-amine is sourced from PubChem (CID 62485288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).