1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine

C14H29NO2 — CID 102927972

IUPAC1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine
SMILESCCC1CCCCC1C(N)CCOCCOC
InChIInChI=1S/C14H29NO2/c1-3-12-6-4-5-7-13(12)14(15)8-9-17-11-10-16-2/h12-14H,3-11,15H2,1-2H3
InChIKeyMOYMKDQSGCHXIQ-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.58
Rot. Bonds8

About 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine

1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine (PubChem CID 102927972) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine
PubChem CID102927972
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine
SMILESCCC1CCCCC1C(N)CCOCCOC
InChIInChI=1S/C14H29NO2/c1-3-12-6-4-5-7-13(12)14(15)8-9-17-11-10-16-2/h12-14H,3-11,15H2,1-2H3
InChIKeyMOYMKDQSGCHXIQ-UHFFFAOYSA-N
XLogP2.58
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-Ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 113780903
3-(2,2-Difluoroethoxy)-1-(2-ethylcyclohexyl)propan-1-amine
CID 113781000
1-(3,3-Difluorocyclohexyl)-4-(2-methoxyethoxy)butan-2-amine
CID 114224955
4-(3-Propoxypropyl)cyclohexan-1-amine
CID 68317197
3-[4-(2-Methoxyethoxy)butan-2-yl]heptan-1-amine
CID 126599165
1-Cyclohexyl-3-methoxypropan-1-amine
CID 61412919
1-Cyclohexyl-4-methoxybutan-1-amine
CID 62602209
1-Cyclohexyl-4-methoxybutan-2-amine
CID 62605711
1-(2-Ethylcyclohexyl)-3-methoxypropan-1-amine
CID 63862729
1-(2-Ethylcyclohexyl)-2-propoxyethanamine
CID 63862730
1-(2-ethylcyclohexyl)-3-methoxy-N-methylpropan-1-amine
CID 63862909
1-(2-Ethylcyclohexyl)-2-(oxolan-2-yl)ethanamine
CID 63863454

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine?
The IUPAC name of 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine (CID 102927972) is 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine.
What is the SMILES notation for 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine?
The canonical SMILES for 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine is CCC1CCCCC1C(N)CCOCCOC.
What is the InChIKey of 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine?
The InChIKey is MOYMKDQSGCHXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-3-12-6-4-5-7-13(12)14(15)8-9-17-11-10-16-2/h12-14H,3-11,15H2,1-2H3.
What are the key properties of 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine?
1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)-3-(2-methoxyethoxy)propan-1-amine is sourced from PubChem (CID 102927972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).