N,N,5-trimethyl-4-oxoheptanamide

C10H19NO2 — CID 88975124

IUPACN,N,5-trimethyl-4-oxoheptanamide
SMILESCCC(C)C(=O)CCC(=O)N(C)C
InChIInChI=1S/C10H19NO2/c1-5-8(2)9(12)6-7-10(13)11(3)4/h8H,5-7H2,1-4H3
InChIKeyGYBXBNNMGBTCFQ-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.47
Rot. Bonds5

About N,N,5-trimethyl-4-oxoheptanamide

N,N,5-trimethyl-4-oxoheptanamide (PubChem CID 88975124) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N,N,5-trimethyl-4-oxoheptanamide.

Molecular Properties

Compound NameN,N,5-trimethyl-4-oxoheptanamide
PubChem CID88975124
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN,N,5-trimethyl-4-oxoheptanamide
SMILESCCC(C)C(=O)CCC(=O)N(C)C
InChIInChI=1S/C10H19NO2/c1-5-8(2)9(12)6-7-10(13)11(3)4/h8H,5-7H2,1-4H3
InChIKeyGYBXBNNMGBTCFQ-UHFFFAOYSA-N
XLogP1.47
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N,5-trimethyl-4-oxoheptanamide 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-methyl-4-oxoheptanoic acid
CID 21365481
1-(diethylamino)-4-methylhexan-3-one
CID 79446320
15-(dimethylamino)-3-methylpentadecan-4-one
CID 143840613
diiminoazanium;3-methylheptan-4-one
CID 175383752
3,7,7-trimethyloctan-4-one
CID 63717585
2,19-dimethylhenicosane-3,18-dione
CID 138498522
N,N-dimethylbutanamide;hydrochloride
CID 87498306
methane;N,N,4-trimethylpentanamide
CID 160907901
(4-methyl-3-oxohexyl) 2-methylbutanoate
CID 58175067
8-methyl-7-oxodecanoic acid
CID 121216549
9-methylundecane-2,8-dione
CID 178033213
N,N-dimethyl-3-(3-methylpentan-2-ylamino)propanamide
CID 60925489

Frequently Asked Questions

What is the IUPAC name of N,N,5-trimethyl-4-oxoheptanamide?
The IUPAC name of N,N,5-trimethyl-4-oxoheptanamide (CID 88975124) is N,N,5-trimethyl-4-oxoheptanamide.
What is the SMILES notation for N,N,5-trimethyl-4-oxoheptanamide?
The canonical SMILES for N,N,5-trimethyl-4-oxoheptanamide is CCC(C)C(=O)CCC(=O)N(C)C.
What is the InChIKey of N,N,5-trimethyl-4-oxoheptanamide?
The InChIKey is GYBXBNNMGBTCFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-5-8(2)9(12)6-7-10(13)11(3)4/h8H,5-7H2,1-4H3.
What are the key properties of N,N,5-trimethyl-4-oxoheptanamide?
N,N,5-trimethyl-4-oxoheptanamide has a molecular weight of 185.27 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-trimethyl-4-oxoheptanamide is sourced from PubChem (CID 88975124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).