3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide

C13H26N2O2 — CID 62782108

IUPAC3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
SMILESCCN(CCOC)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C13H26N2O2/c1-4-15(7-8-17-3)13(16)11-6-5-10(2)12(14)9-11/h10-12H,4-9,14H2,1-3H3
InChIKeyYAPGOBGENLWABY-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.24
Rot. Bonds5

About 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide

3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide (PubChem CID 62782108) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
PubChem CID62782108
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
SMILESCCN(CCOC)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C13H26N2O2/c1-4-15(7-8-17-3)13(16)11-6-5-10(2)12(14)9-11/h10-12H,4-9,14H2,1-3H3
InChIKeyYAPGOBGENLWABY-UHFFFAOYSA-N
XLogP1.24
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
CID 62777554
3-amino-N-ethyl-N,4-dimethylcyclohexane-1-carboxamide
CID 62782994
3-amino-N-butan-2-yl-N-ethyl-4-methylcyclohexane-1-carboxamide
CID 62782504
3-[2-methoxyethyl(3-methoxypropyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550455
3-amino-N-butyl-N-(2-hydroxyethyl)-4-methylcyclohexane-1-carboxamide
CID 55117107
4-amino-N-butyl-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 62781326
3-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)cyclopentane-1-carboxamide
CID 66009602
N-ethyl-N-(2-methoxyethyl)-3-methylpyrrolidine-2-carboxamide
CID 102779207
3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
CID 81074064
3-amino-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 66008773
(3S)-N-ethyl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81141076
3-[2-ethoxyethyl(ethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 55237345

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide (CID 62782108) is 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide is CCN(CCOC)C(=O)C1CCC(C)C(N)C1.
What is the InChIKey of 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide?
The InChIKey is YAPGOBGENLWABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-15(7-8-17-3)13(16)11-6-5-10(2)12(14)9-11/h10-12H,4-9,14H2,1-3H3.
What are the key properties of 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide?
3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide has a molecular weight of 242.36 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62782108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).