(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide

C12H24N2O2 — CID 95211996

IUPAC(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide
SMILESCC(C)C[C@@H](C)CC(=O)NCC(=O)N(C)C
InChIInChI=1S/C12H24N2O2/c1-9(2)6-10(3)7-11(15)13-8-12(16)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t10-/m1/s1
InChIKeyPUIDAHKIXTWQJN-SNVBAGLBSA-N
MW228.34 g/mol
LogP1.26
Rot. Bonds6

About (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide

(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide (PubChem CID 95211996) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide.

Molecular Properties

Compound Name(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide
PubChem CID95211996
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide
SMILESCC(C)C[C@@H](C)CC(=O)NCC(=O)N(C)C
InChIInChI=1S/C12H24N2O2/c1-9(2)6-10(3)7-11(15)13-8-12(16)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t10-/m1/s1
InChIKeyPUIDAHKIXTWQJN-SNVBAGLBSA-N
XLogP1.26
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[2-(dimethylamino)-2-oxoethyl]amino]-3-methyl-5-oxopentanoic acid
CID 62963822
N,N-dimethyl-2-(4-methylpentan-2-ylamino)acetamide
CID 43310901
N-(3-amino-2-methylpropyl)-3,5-dimethylhexanamide;hydrochloride
CID 119995769
N-[2-(dimethylamino)-2-oxoethyl]-3-hydroxypropanamide
CID 20719167
N-[2-(dimethylamino)-2-oxoethyl]-3-methyl-2-(methylamino)butanamide;ethane
CID 162738491
ethyl 2-(3,5-dimethylhexanoylamino)propanoate
CID 71879687
2-[[2-[[2-(dimethylamino)-2-oxoethyl]carbamoylamino]acetyl]amino]acetic acid
CID 61197433
N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide
CID 131892803
[4-[[2-(dimethylamino)-2-oxoethyl]amino]-2,4-dioxobutanoyl]-trimethylazanium
CID 90239142
5-bromo-N-[2-(dimethylamino)-2-oxoethyl]pentanamide
CID 107907997
N-[(1R)-3-[[2-(dimethylamino)-2-oxoethyl]amino]-3-oxo-1-phenylpropyl]benzamide
CID 9480729
2-(3,3-dimethylbutan-2-ylcarbamoylamino)-N,N-dimethylacetamide
CID 143361850

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide?
The IUPAC name of (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide (CID 95211996) is (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide.
What is the SMILES notation for (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide?
The canonical SMILES for (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide is CC(C)C[C@@H](C)CC(=O)NCC(=O)N(C)C.
What is the InChIKey of (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide?
The InChIKey is PUIDAHKIXTWQJN-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(2)6-10(3)7-11(15)13-8-12(16)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t10-/m1/s1.
What are the key properties of (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide?
(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide has a molecular weight of 228.34 g/mol, XLogP of 1.26, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide is sourced from PubChem (CID 95211996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).