1-cycloheptyl-N-ethyl-2-methoxyethanamine

C12H25NO — CID 79574660

IUPAC1-cycloheptyl-N-ethyl-2-methoxyethanamine
SMILESCCNC(COC)C1CCCCCC1
InChIInChI=1S/C12H25NO/c1-3-13-12(10-14-2)11-8-6-4-5-7-9-11/h11-13H,3-10H2,1-2H3
InChIKeyCGSNLOGMTIUAEE-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds5

About 1-cycloheptyl-N-ethyl-2-methoxyethanamine

1-cycloheptyl-N-ethyl-2-methoxyethanamine (PubChem CID 79574660) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 1-cycloheptyl-N-ethyl-2-methoxyethanamine.

Molecular Properties

Compound Name1-cycloheptyl-N-ethyl-2-methoxyethanamine
PubChem CID79574660
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name1-cycloheptyl-N-ethyl-2-methoxyethanamine
SMILESCCNC(COC)C1CCCCCC1
InChIInChI=1S/C12H25NO/c1-3-13-12(10-14-2)11-8-6-4-5-7-9-11/h11-13H,3-10H2,1-2H3
InChIKeyCGSNLOGMTIUAEE-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine
CID 104748657
1-cyclohexyl-N-ethyl-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447381
1-cyclopentyl-N-ethyl-2-propan-2-yloxyethanamine
CID 79574827
2-butoxy-1-cyclopentyl-N-ethylethanamine
CID 104749090
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
1-(4,4-difluorocyclohexyl)-N-ethyl-2-methoxyethanamine
CID 105165589
N-(1-cyclohexyl-2-methoxyethyl)propan-2-amine
CID 83686426
1-cyclohexyl-N-ethyl-N'-(3-methoxypropyl)-N'-methylethane-1,2-diamine
CID 113448229
1-cyclopropyl-N-ethyl-4-methoxy-3-methylbutan-1-amine
CID 105157171
1-cyclopentyl-N-ethyl-6-methoxyhexan-1-amine
CID 104648397
1,2-di(cycloheptyl)-N-ethylethanamine
CID 105027799
1-cycloheptyl-2-cyclohexyl-N-ethylethanamine
CID 65399491

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-N-ethyl-2-methoxyethanamine?
The IUPAC name of 1-cycloheptyl-N-ethyl-2-methoxyethanamine (CID 79574660) is 1-cycloheptyl-N-ethyl-2-methoxyethanamine.
What is the SMILES notation for 1-cycloheptyl-N-ethyl-2-methoxyethanamine?
The canonical SMILES for 1-cycloheptyl-N-ethyl-2-methoxyethanamine is CCNC(COC)C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-N-ethyl-2-methoxyethanamine?
The InChIKey is CGSNLOGMTIUAEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-13-12(10-14-2)11-8-6-4-5-7-9-11/h11-13H,3-10H2,1-2H3.
What are the key properties of 1-cycloheptyl-N-ethyl-2-methoxyethanamine?
1-cycloheptyl-N-ethyl-2-methoxyethanamine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-N-ethyl-2-methoxyethanamine is sourced from PubChem (CID 79574660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).