3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide

C14H28N2O2 — CID 81074064

IUPAC3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
SMILESCC(C)OCCN(C)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C14H28N2O2/c1-10(2)18-8-7-16(4)14(17)12-6-5-11(3)13(15)9-12/h10-13H,5-9,15H2,1-4H3
InChIKeyFMNGZKWCLJGUMI-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.63
Rot. Bonds5

About 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide

3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide (PubChem CID 81074064) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
PubChem CID81074064
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
SMILESCC(C)OCCN(C)C(=O)C1CCC(C)C(N)C1
InChIInChI=1S/C14H28N2O2/c1-10(2)18-8-7-16(4)14(17)12-6-5-11(3)13(15)9-12/h10-13H,5-9,15H2,1-4H3
InChIKeyFMNGZKWCLJGUMI-UHFFFAOYSA-N
XLogP1.63
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-ethyl-N,4-dimethylcyclohexane-1-carboxamide
CID 62782994
3-(aminomethyl)-N-methyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
CID 81074510
3-amino-N,2-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
CID 81074150
4-amino-N-(3-hydroxybutyl)-N,3-dimethylcyclohexane-1-carboxamide
CID 113499950
3-amino-N-butan-2-yl-N-ethyl-4-methylcyclohexane-1-carboxamide
CID 62782504
N-methyl-N-(2-propan-2-yloxyethyl)piperidine-3-carboxamide
CID 81055489
3-amino-N-ethyl-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
CID 62782108
3-amino-N,N-diethyl-4-methylcyclohexane-1-carboxamide
CID 62777554
N,3-dimethyl-N-(2-propan-2-yloxyethyl)piperidine-2-carboxamide
CID 81056495
4-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylcyclohexane-1-carboxamide
CID 55227956
2-(2-aminocyclohexyl)-N-methyl-N-(2-propan-2-yloxyethyl)acetamide
CID 81074151
3-amino-N,4-dimethyl-N-[2-oxo-2-(propylamino)ethyl]cyclohexane-1-carboxamide
CID 55116667

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide (CID 81074064) is 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide is CC(C)OCCN(C)C(=O)C1CCC(C)C(N)C1.
What is the InChIKey of 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide?
The InChIKey is FMNGZKWCLJGUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-10(2)18-8-7-16(4)14(17)12-6-5-11(3)13(15)9-12/h10-13H,5-9,15H2,1-4H3.
What are the key properties of 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide?
3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 81074064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).