N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide

C16H31NO2 — CID 176576878

IUPACN,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide
SMILESCC(C)C(=O)CCCCCCCN(C)C(=O)C(C)C
InChIInChI=1S/C16H31NO2/c1-13(2)15(18)11-9-7-6-8-10-12-17(5)16(19)14(3)4/h13-14H,6-12H2,1-5H3
InChIKeySKLVTJUEIUQHBQ-UHFFFAOYSA-N
MW269.43 g/mol
LogP3.67
Rot. Bonds10

About N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide

N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide (PubChem CID 176576878) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide
PubChem CID176576878
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC NameN,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide
SMILESCC(C)C(=O)CCCCCCCN(C)C(=O)C(C)C
InChIInChI=1S/C16H31NO2/c1-13(2)15(18)11-9-7-6-8-10-12-17(5)16(19)14(3)4/h13-14H,6-12H2,1-5H3
InChIKeySKLVTJUEIUQHBQ-UHFFFAOYSA-N
XLogP3.67
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N,2-dimethyl-N-(7-methyl-6-oxooctyl)-4-oxobutanamide
CID 146665726
N,2-dimethyl-N-(8-methylnonyl)propanamide
CID 161045695
N-butyl-N,2-dimethylpropanamide
CID 21413636
N,17-dimethyl-N-(2-methylpropyl)-16-oxooctadecanamide
CID 169316878
N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide
CID 166695144
5-methyl-N-[2-[methyl(2-methylpropanoyl)amino]ethyl]-4-oxohexanamide
CID 88917606
N,2-dimethyl-N-[5-(4-methylpentylamino)pentyl]propanamide
CID 138727866
2-methylhexadecan-3-one
CID 58030381
14-methylpentadecane-2,13-dione
CID 88544438
9-methyl-8-oxodecanamide
CID 168891746
N,2-dimethyl-N-(3-methyl-2-oxobutyl)propanamide
CID 58885009
N,8-dimethyl-N-[6-(N-methylanilino)-6-oxohexyl]-7-oxononanamide
CID 58223937

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide?
The IUPAC name of N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide (CID 176576878) is N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide is CC(C)C(=O)CCCCCCCN(C)C(=O)C(C)C.
What is the InChIKey of N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide?
The InChIKey is SKLVTJUEIUQHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-13(2)15(18)11-9-7-6-8-10-12-17(5)16(19)14(3)4/h13-14H,6-12H2,1-5H3.
What are the key properties of N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide?
N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide has a molecular weight of 269.43 g/mol, XLogP of 3.67, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(9-methyl-8-oxodecyl)propanamide is sourced from PubChem (CID 176576878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).