N,N-dihexylprop-2-enamide

C15H29NO — CID 10857576

IUPACN,N-dihexylprop-2-enamide
SMILESC=CC(=O)N(CCCCCC)CCCCCC
InChIInChI=1S/C15H29NO/c1-4-7-9-11-13-16(15(17)6-3)14-12-10-8-5-2/h6H,3-5,7-14H2,1-2H3
InChIKeyZLSJVVLETDAEQY-UHFFFAOYSA-N
MW239.40 g/mol
LogP4.16
Rot. Bonds11

About N,N-dihexylprop-2-enamide

N,N-dihexylprop-2-enamide (PubChem CID 10857576) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N,N-dihexylprop-2-enamide.

Molecular Properties

Compound NameN,N-dihexylprop-2-enamide
PubChem CID10857576
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN,N-dihexylprop-2-enamide
SMILESC=CC(=O)N(CCCCCC)CCCCCC
InChIInChI=1S/C15H29NO/c1-4-7-9-11-13-16(15(17)6-3)14-12-10-8-5-2/h6H,3-5,7-14H2,1-2H3
InChIKeyZLSJVVLETDAEQY-UHFFFAOYSA-N
XLogP4.16
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dihexylprop-2-enamide?
The IUPAC name of N,N-dihexylprop-2-enamide (CID 10857576) is N,N-dihexylprop-2-enamide.
What is the SMILES notation for N,N-dihexylprop-2-enamide?
The canonical SMILES for N,N-dihexylprop-2-enamide is C=CC(=O)N(CCCCCC)CCCCCC.
What is the InChIKey of N,N-dihexylprop-2-enamide?
The InChIKey is ZLSJVVLETDAEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-7-9-11-13-16(15(17)6-3)14-12-10-8-5-2/h6H,3-5,7-14H2,1-2H3.
What are the key properties of N,N-dihexylprop-2-enamide?
N,N-dihexylprop-2-enamide has a molecular weight of 239.40 g/mol, XLogP of 4.16, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dihexylprop-2-enamide is sourced from PubChem (CID 10857576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).