3-(dipropylamino)-N-(2-ethylhexyl)propanamide

C17H36N2O — CID 23363411

IUPAC3-(dipropylamino)-N-(2-ethylhexyl)propanamide
SMILESCCCCC(CC)CNC(=O)CCN(CCC)CCC
InChIInChI=1S/C17H36N2O/c1-5-9-10-16(8-4)15-18-17(20)11-14-19(12-6-2)13-7-3/h16H,5-15H2,1-4H3,(H,18,20)
InChIKeyYEFHVKZOYUCOPZ-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.83
Rot. Bonds13

About 3-(dipropylamino)-N-(2-ethylhexyl)propanamide

3-(dipropylamino)-N-(2-ethylhexyl)propanamide (PubChem CID 23363411) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 3-(dipropylamino)-N-(2-ethylhexyl)propanamide.

Molecular Properties

Compound Name3-(dipropylamino)-N-(2-ethylhexyl)propanamide
PubChem CID23363411
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name3-(dipropylamino)-N-(2-ethylhexyl)propanamide
SMILESCCCCC(CC)CNC(=O)CCN(CCC)CCC
InChIInChI=1S/C17H36N2O/c1-5-9-10-16(8-4)15-18-17(20)11-14-19(12-6-2)13-7-3/h16H,5-15H2,1-4H3,(H,18,20)
InChIKeyYEFHVKZOYUCOPZ-UHFFFAOYSA-N
XLogP3.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dipropylamino)-N-(2-ethylhexyl)propanamide?
The IUPAC name of 3-(dipropylamino)-N-(2-ethylhexyl)propanamide (CID 23363411) is 3-(dipropylamino)-N-(2-ethylhexyl)propanamide.
What is the SMILES notation for 3-(dipropylamino)-N-(2-ethylhexyl)propanamide?
The canonical SMILES for 3-(dipropylamino)-N-(2-ethylhexyl)propanamide is CCCCC(CC)CNC(=O)CCN(CCC)CCC.
What is the InChIKey of 3-(dipropylamino)-N-(2-ethylhexyl)propanamide?
The InChIKey is YEFHVKZOYUCOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-5-9-10-16(8-4)15-18-17(20)11-14-19(12-6-2)13-7-3/h16H,5-15H2,1-4H3,(H,18,20).
What are the key properties of 3-(dipropylamino)-N-(2-ethylhexyl)propanamide?
3-(dipropylamino)-N-(2-ethylhexyl)propanamide has a molecular weight of 284.49 g/mol, XLogP of 3.83, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dipropylamino)-N-(2-ethylhexyl)propanamide is sourced from PubChem (CID 23363411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).