(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide

C14H25NO — CID 170794444

IUPAC(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide
SMILESCCC/C=C(\C)N(C)C(=O)/C(C)=C(/C)CC
InChIInChI=1S/C14H25NO/c1-7-9-10-12(4)15(6)14(16)13(5)11(3)8-2/h10H,7-9H2,1-6H3/b12-10+,13-11-
InChIKeyQGHCIGJSXRMHFU-FAEGWCMCSA-N
MW223.36 g/mol
LogP3.90
Rot. Bonds5

About (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide

(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide (PubChem CID 170794444) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide.

Molecular Properties

Compound Name(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide
PubChem CID170794444
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide
SMILESCCC/C=C(\C)N(C)C(=O)/C(C)=C(/C)CC
InChIInChI=1S/C14H25NO/c1-7-9-10-12(4)15(6)14(16)13(5)11(3)8-2/h10H,7-9H2,1-6H3/b12-10+,13-11-
InChIKeyQGHCIGJSXRMHFU-FAEGWCMCSA-N
XLogP3.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-4,6-dimethyl-2(1H)-pyridone
CID 21538594
(Z)-N-[(3E)-5-fluoro-6-methylhepta-3,5-dien-3-yl]-N-methylpent-2-enamide
CID 143577542
Ethane;1,3,6-trimethyl-4-(trifluoromethyl)pyridin-2-one
CID 153576822
2(1H)-Pyridinone, 1,4,6-trimethyl-
CID 586244
1,4-Dimethyl-5-propan-2-ylidenepyrrol-2-one
CID 134831218
1,3,4,6-Tetramethylpyridin-2-one
CID 12913257
3-Ethyl-1,6-dimethylpyridin-2-one
CID 13597164
(E)-N,N-diethyl-2-methylpent-2-enamide
CID 14773864
(E)-N,N,2-trimethylhex-2-enamide
CID 20262731
1-butyl-6-methyl-3,4-dihydro-2H-azepin-7-one
CID 23382665
6-Ethenyl-1,4-dimethylpyridin-2-one
CID 53882754
2-ethyl-1,4-dimethyl-2H-pyrrol-5-one
CID 53984613

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide?
The IUPAC name of (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide (CID 170794444) is (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide.
What is the SMILES notation for (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide?
The canonical SMILES for (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide is CCC/C=C(\C)N(C)C(=O)/C(C)=C(/C)CC.
What is the InChIKey of (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide?
The InChIKey is QGHCIGJSXRMHFU-FAEGWCMCSA-N. The full InChI is InChI=1S/C14H25NO/c1-7-9-10-12(4)15(6)14(16)13(5)11(3)8-2/h10H,7-9H2,1-6H3/b12-10+,13-11-.
What are the key properties of (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide?
(Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.90, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(E)-hex-2-en-2-yl]-N,2,3-trimethylpent-2-enamide is sourced from PubChem (CID 170794444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).