4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide

C12H23N3O2 — CID 60846900

IUPAC4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide
SMILESCN(C)C(=O)CN(C)C(=O)C1CCC(N)CC1
InChIInChI=1S/C12H23N3O2/c1-14(2)11(16)8-15(3)12(17)9-4-6-10(13)7-5-9/h9-10H,4-8,13H2,1-3H3
InChIKeyRHICUPXLZHATMA-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.05
Rot. Bonds3

About 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide

4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide (PubChem CID 60846900) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide
PubChem CID60846900
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide
SMILESCN(C)C(=O)CN(C)C(=O)C1CCC(N)CC1
InChIInChI=1S/C12H23N3O2/c1-14(2)11(16)8-15(3)12(17)9-4-6-10(13)7-5-9/h9-10H,4-8,13H2,1-3H3
InChIKeyRHICUPXLZHATMA-UHFFFAOYSA-N
XLogP0.05
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 60846741
N-[2-(dimethylamino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide
CID 43375315
9-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylbicyclo[3.3.1]nonane-3-carboxamide
CID 120984156
3-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119686528
N-[2-(dimethylamino)-2-oxoethyl]-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119687382
4-amino-N-methyl-N-(2-methylbutyl)cyclohexane-1-carboxamide
CID 60847602
2-(4-aminocyclohexyl)-N,N-dimethylacetamide
CID 62781479
4-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113264331
4-amino-N-methyl-N-[(4-methylphenyl)methyl]cyclohexane-1-carboxamide
CID 60847411
2-(4-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-methylacetamide
CID 62782843
3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
CID 66010622
3-amino-N-methyl-N-propylcyclopentane-1-carboxamide
CID 66031475

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide (CID 60846900) is 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide is CN(C)C(=O)CN(C)C(=O)C1CCC(N)CC1.
What is the InChIKey of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide?
The InChIKey is RHICUPXLZHATMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-14(2)11(16)8-15(3)12(17)9-4-6-10(13)7-5-9/h9-10H,4-8,13H2,1-3H3.
What are the key properties of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide?
4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 60846900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).