N-methyl-N-octylnonanamide

C18H37NO — CID 140654825

IUPACN-methyl-N-octylnonanamide
SMILESCCCCCCCCC(=O)N(C)CCCCCCCC
InChIInChI=1S/C18H37NO/c1-4-6-8-10-12-14-16-18(20)19(3)17-15-13-11-9-7-5-2/h4-17H2,1-3H3
InChIKeyMCJPJYSKUANDPD-UHFFFAOYSA-N
MW283.50 g/mol
LogP5.56
Rot. Bonds14

About N-methyl-N-octylnonanamide

N-methyl-N-octylnonanamide (PubChem CID 140654825) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is N-methyl-N-octylnonanamide.

Molecular Properties

Compound NameN-methyl-N-octylnonanamide
PubChem CID140654825
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC NameN-methyl-N-octylnonanamide
SMILESCCCCCCCCC(=O)N(C)CCCCCCCC
InChIInChI=1S/C18H37NO/c1-4-6-8-10-12-14-16-18(20)19(3)17-15-13-11-9-7-5-2/h4-17H2,1-3H3
InChIKeyMCJPJYSKUANDPD-UHFFFAOYSA-N
XLogP5.56
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.50
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-N-octylnonanamide 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

N-methyl-N-octylheptacosanamide
CID 87394998
10-[methyl(pentyl)amino]-10-oxodecanoic acid
CID 143390074
N-(5-hydroxypentyl)-N-methyldodecanamide
CID 107201995
N-(3-aminopropyl)-N-methylheptanamide
CID 115737512
N-(3-aminopropyl)-N-methyldecanamide
CID 65447774
N-(3-aminopropyl)-N-methyloctanamide
CID 43125160
N-(3-hydroxypropyl)-N-methyldecanamide
CID 59366231
4-[heptanoyl(methyl)amino]butanoic acid
CID 43172442
4-hydroxy-N-methyl-N-pentylbutanamide
CID 79203931
N-(5-hydroxyhexyl)-N-methyloctanamide
CID 143646438
CID 88685642
CID 88685642
sodium 3-[methyl(tetradecanoyl)amino]propanoic acid
CID 22614079

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-octylnonanamide?
The IUPAC name of N-methyl-N-octylnonanamide (CID 140654825) is N-methyl-N-octylnonanamide.
What is the SMILES notation for N-methyl-N-octylnonanamide?
The canonical SMILES for N-methyl-N-octylnonanamide is CCCCCCCCC(=O)N(C)CCCCCCCC.
What is the InChIKey of N-methyl-N-octylnonanamide?
The InChIKey is MCJPJYSKUANDPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-4-6-8-10-12-14-16-18(20)19(3)17-15-13-11-9-7-5-2/h4-17H2,1-3H3.
What are the key properties of N-methyl-N-octylnonanamide?
N-methyl-N-octylnonanamide has a molecular weight of 283.50 g/mol, XLogP of 5.56, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-octylnonanamide is sourced from PubChem (CID 140654825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).