3-[acetyl(propyl)amino]-N,N-dipropylpropanamide

C14H28N2O2 — CID 113114998

IUPAC3-[acetyl(propyl)amino]-N,N-dipropylpropanamide
SMILESCCCN(CCC(=O)N(CCC)CCC)C(C)=O
InChIInChI=1S/C14H28N2O2/c1-5-9-15(13(4)17)12-8-14(18)16(10-6-2)11-7-3/h5-12H2,1-4H3
InChIKeyGEOIPRALSRBJRR-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.28
Rot. Bonds9

About 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide

3-[acetyl(propyl)amino]-N,N-dipropylpropanamide (PubChem CID 113114998) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide.

Molecular Properties

Compound Name3-[acetyl(propyl)amino]-N,N-dipropylpropanamide
PubChem CID113114998
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-[acetyl(propyl)amino]-N,N-dipropylpropanamide
SMILESCCCN(CCC(=O)N(CCC)CCC)C(C)=O
InChIInChI=1S/C14H28N2O2/c1-5-9-15(13(4)17)12-8-14(18)16(10-6-2)11-7-3/h5-12H2,1-4H3
InChIKeyGEOIPRALSRBJRR-UHFFFAOYSA-N
XLogP2.28
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide?
The IUPAC name of 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide (CID 113114998) is 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide.
What is the SMILES notation for 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide?
The canonical SMILES for 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide is CCCN(CCC(=O)N(CCC)CCC)C(C)=O.
What is the InChIKey of 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide?
The InChIKey is GEOIPRALSRBJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-9-15(13(4)17)12-8-14(18)16(10-6-2)11-7-3/h5-12H2,1-4H3.
What are the key properties of 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide?
3-[acetyl(propyl)amino]-N,N-dipropylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 2.28, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[acetyl(propyl)amino]-N,N-dipropylpropanamide is sourced from PubChem (CID 113114998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).