N-methyl-5-oxo-2-(propylamino)octanamide

C12H24N2O2 — CID 56997409

IUPACN-methyl-5-oxo-2-(propylamino)octanamide
SMILESCCCNC(CCC(=O)CCC)C(=O)NC
InChIInChI=1S/C12H24N2O2/c1-4-6-10(15)7-8-11(12(16)13-3)14-9-5-2/h11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyGCPUENGPBZSBLL-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.25
Rot. Bonds9

About N-methyl-5-oxo-2-(propylamino)octanamide

N-methyl-5-oxo-2-(propylamino)octanamide (PubChem CID 56997409) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-methyl-5-oxo-2-(propylamino)octanamide.

Molecular Properties

Compound NameN-methyl-5-oxo-2-(propylamino)octanamide
PubChem CID56997409
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-methyl-5-oxo-2-(propylamino)octanamide
SMILESCCCNC(CCC(=O)CCC)C(=O)NC
InChIInChI=1S/C12H24N2O2/c1-4-6-10(15)7-8-11(12(16)13-3)14-9-5-2/h11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyGCPUENGPBZSBLL-UHFFFAOYSA-N
XLogP1.25
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2-aminoethylamino)-N-methylheptanamide
CID 58592369
2-[[4-carboxy-4-[[4-carboxy-4-(methylamino)butanoyl]amino]butanoyl]amino]-5-oxooctanoic acid
CID 176567888
(2S)-N-methyl-2-(methylamino)pentanamide
CID 143782023
(2S)-3-hydroxy-2-(propylamino)propanoic acid
CID 55287062
7-ethylnonan-4-one
CID 537776
2-(diethylamino)-N-methyl-2-(propylamino)acetamide
CID 173048616
2-(propylamino)tetradecanoic acid
CID 54527307
calcium;hydride;4-hydroxy-2-(propylamino)butanoic acid;radon
CID 174783521
18-[[(1S)-1-carboxy-4-oxoheptyl]amino]-18-oxooctadecanoic acid
CID 89403948
2-[2-[(2-amino-5-oxooctanoyl)amino]propanoylamino]butanoic acid
CID 159332078
N-methyl-2-[3-(methylamino)propanoylamino]pentanamide;hydrochloride
CID 155820102
3,5-bis(propylamino)heptane-2,6-dione
CID 21339708

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-oxo-2-(propylamino)octanamide?
The IUPAC name of N-methyl-5-oxo-2-(propylamino)octanamide (CID 56997409) is N-methyl-5-oxo-2-(propylamino)octanamide.
What is the SMILES notation for N-methyl-5-oxo-2-(propylamino)octanamide?
The canonical SMILES for N-methyl-5-oxo-2-(propylamino)octanamide is CCCNC(CCC(=O)CCC)C(=O)NC.
What is the InChIKey of N-methyl-5-oxo-2-(propylamino)octanamide?
The InChIKey is GCPUENGPBZSBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-6-10(15)7-8-11(12(16)13-3)14-9-5-2/h11,14H,4-9H2,1-3H3,(H,13,16).
What are the key properties of N-methyl-5-oxo-2-(propylamino)octanamide?
N-methyl-5-oxo-2-(propylamino)octanamide has a molecular weight of 228.34 g/mol, XLogP of 1.25, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-oxo-2-(propylamino)octanamide is sourced from PubChem (CID 56997409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).