2,2-dipropylpent-4-enamide

C11H21NO — CID 71370443

IUPAC2,2-dipropylpent-4-enamide
SMILESC=CCC(CCC)(CCC)C(N)=O
InChIInChI=1S/C11H21NO/c1-4-7-11(8-5-2,9-6-3)10(12)13/h4H,1,5-9H2,2-3H3,(H2,12,13)
InChIKeyKVNDGTOBBZJLLO-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.63
Rot. Bonds7

About 2,2-dipropylpent-4-enamide

2,2-dipropylpent-4-enamide (PubChem CID 71370443) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2,2-dipropylpent-4-enamide.

Molecular Properties

Compound Name2,2-dipropylpent-4-enamide
PubChem CID71370443
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2,2-dipropylpent-4-enamide
SMILESC=CCC(CCC)(CCC)C(N)=O
InChIInChI=1S/C11H21NO/c1-4-7-11(8-5-2,9-6-3)10(12)13/h4H,1,5-9H2,2-3H3,(H2,12,13)
InChIKeyKVNDGTOBBZJLLO-UHFFFAOYSA-N
XLogP2.63
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Valdetamide
CID 68845
1-Methylcyclohex-3-ene-1-carboximidic acid
CID 3052840
Propylallylacetamide
CID 146140
Tri-allylacetamid
CID 87074718
n-Butyl-diallylacetamid
CID 87126840
n-Propyl-diallylacetamid
CID 129891366
2-(1-Methylethyl)-2-(2-propen-1-yl)-4-pentenamide
CID 129891372
(1S)-1-fluoro-6,6-dimethylcyclohept-3-ene-1-carboxamide
CID 177059224
(2R)-2-fluoro-2-[(1-methylcyclobutyl)methyl]pent-4-enamide
CID 177059800
2,2,6-Trimethylhept-6-enamide
CID 15311311
(Z)-6-iodo-2,2-dimethylhex-5-enamide
CID 23655794
1-Prop-2-enylcyclohexane-1-carboxamide
CID 15707441

Frequently Asked Questions

What is the IUPAC name of 2,2-dipropylpent-4-enamide?
The IUPAC name of 2,2-dipropylpent-4-enamide (CID 71370443) is 2,2-dipropylpent-4-enamide.
What is the SMILES notation for 2,2-dipropylpent-4-enamide?
The canonical SMILES for 2,2-dipropylpent-4-enamide is C=CCC(CCC)(CCC)C(N)=O.
What is the InChIKey of 2,2-dipropylpent-4-enamide?
The InChIKey is KVNDGTOBBZJLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-7-11(8-5-2,9-6-3)10(12)13/h4H,1,5-9H2,2-3H3,(H2,12,13).
What are the key properties of 2,2-dipropylpent-4-enamide?
2,2-dipropylpent-4-enamide has a molecular weight of 183.29 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dipropylpent-4-enamide is sourced from PubChem (CID 71370443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).