8-methyl-N,N-dipropylnonanamide

C16H33NO — CID 170848967

IUPAC8-methyl-N,N-dipropylnonanamide
SMILESCCCN(CCC)C(=O)CCCCCCC(C)C
InChIInChI=1S/C16H33NO/c1-5-13-17(14-6-2)16(18)12-10-8-7-9-11-15(3)4/h15H,5-14H2,1-4H3
InChIKeyWNYRVYZABCIKLY-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.63
Rot. Bonds11

About 8-methyl-N,N-dipropylnonanamide

8-methyl-N,N-dipropylnonanamide (PubChem CID 170848967) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 8-methyl-N,N-dipropylnonanamide.

Molecular Properties

Compound Name8-methyl-N,N-dipropylnonanamide
PubChem CID170848967
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name8-methyl-N,N-dipropylnonanamide
SMILESCCCN(CCC)C(=O)CCCCCCC(C)C
InChIInChI=1S/C16H33NO/c1-5-13-17(14-6-2)16(18)12-10-8-7-9-11-15(3)4/h15H,5-14H2,1-4H3
InChIKeyWNYRVYZABCIKLY-UHFFFAOYSA-N
XLogP4.63
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-N,N-dipropylnonanamide?
The IUPAC name of 8-methyl-N,N-dipropylnonanamide (CID 170848967) is 8-methyl-N,N-dipropylnonanamide.
What is the SMILES notation for 8-methyl-N,N-dipropylnonanamide?
The canonical SMILES for 8-methyl-N,N-dipropylnonanamide is CCCN(CCC)C(=O)CCCCCCC(C)C.
What is the InChIKey of 8-methyl-N,N-dipropylnonanamide?
The InChIKey is WNYRVYZABCIKLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-5-13-17(14-6-2)16(18)12-10-8-7-9-11-15(3)4/h15H,5-14H2,1-4H3.
What are the key properties of 8-methyl-N,N-dipropylnonanamide?
8-methyl-N,N-dipropylnonanamide has a molecular weight of 255.45 g/mol, XLogP of 4.63, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N,N-dipropylnonanamide is sourced from PubChem (CID 170848967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).