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

C12H23N3O2 — CID 62782833

IUPAC4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)NCC(=O)N(C)C
InChIInChI=1S/C12H23N3O2/c1-8-6-9(13)4-5-10(8)12(17)14-7-11(16)15(2)3/h8-10H,4-7,13H2,1-3H3,(H,14,17)
InChIKeyLHHYXZKRZNDCSX-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.05
Rot. Bonds3

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

4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide (PubChem CID 62782833) 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]-2-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide
PubChem CID62782833
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide
SMILESCC1CC(N)CCC1C(=O)NCC(=O)N(C)C
InChIInChI=1S/C12H23N3O2/c1-8-6-9(13)4-5-10(8)12(17)14-7-11(16)15(2)3/h8-10H,4-7,13H2,1-3H3,(H,14,17)
InChIKeyLHHYXZKRZNDCSX-UHFFFAOYSA-N
XLogP-0.05
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(dimethylamino)-2-oxoethyl]-5-methylcyclohexane-1-carboxamide
CID 65454343
4-amino-2-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
CID 62782527
4-amino-N-[4-(dimethylamino)butyl]-2-methylcyclohexane-1-carboxamide
CID 62782762
4-amino-2-methyl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 62782165
2-amino-N-[2-(dimethylamino)-2-oxoethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119689245
4-amino-2-methyl-N-[(2-methylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 55116865
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-6-methylcyclohexane-1-carboxamide
CID 55116655
4-amino-2-methyl-N-(2-piperidin-1-ylethyl)cyclohexane-1-carboxamide
CID 62782757
(1S,2R,4R)-4-amino-2-methylcyclohexane-1-carboxylic acid
CID 162343513
N-[2-(dimethylamino)-2-oxoethyl]cyclopentanecarboxamide
CID 39969864
4-amino-2-methyl-N-(oxan-2-ylmethyl)cyclohexane-1-carboxamide
CID 62783252
5-amino-N-[3-(dimethylamino)propyl]-2-methylcyclohexane-1-carboxamide
CID 62781307

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide (CID 62782833) is 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide is CC1CC(N)CCC1C(=O)NCC(=O)N(C)C.
What is the InChIKey of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide?
The InChIKey is LHHYXZKRZNDCSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-8-6-9(13)4-5-10(8)12(17)14-7-11(16)15(2)3/h8-10H,4-7,13H2,1-3H3,(H,14,17).
What are the key properties of 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide?
4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(dimethylamino)-2-oxoethyl]-2-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62782833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).