N,N,3-trimethylpent-4-enamide

C8H15NO — CID 10654310

IUPACN,N,3-trimethylpent-4-enamide
SMILESC=CC(C)CC(=O)N(C)C
InChIInChI=1S/C8H15NO/c1-5-7(2)6-8(10)9(3)4/h5,7H,1,6H2,2-4H3
InChIKeyDPFNHNJNPIFMCU-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.29
Rot. Bonds3

About N,N,3-trimethylpent-4-enamide

N,N,3-trimethylpent-4-enamide (PubChem CID 10654310) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N,N,3-trimethylpent-4-enamide.

Molecular Properties

Compound NameN,N,3-trimethylpent-4-enamide
PubChem CID10654310
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN,N,3-trimethylpent-4-enamide
SMILESC=CC(C)CC(=O)N(C)C
InChIInChI=1S/C8H15NO/c1-5-7(2)6-8(10)9(3)4/h5,7H,1,6H2,2-4H3
InChIKeyDPFNHNJNPIFMCU-UHFFFAOYSA-N
XLogP1.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethyl (3R)-3-methylpent-4-enoate
CID 173481995
(4E)-4-(hydroxymethylidene)-2,6-dimethyloct-7-en-3-one
CID 21159772
4-amino-N,N,3-trimethylpentanamide
CID 102537836
2-diazo-5-methylhept-6-en-3-one
CID 72564197
(3R)-N,N,3-trimethylhexanamide
CID 170848594
(4R,6S)-4,6-dimethyloct-7-en-2-one
CID 59788969
3,6-dimethyl-5-methylidenehept-1-ene
CID 91477493
4-but-3-en-2-yloxy-N,N-dimethyl-3-oxobutanamide
CID 86085209
N,N-dimethyl-3-(methylamino)-4-oxobutanamide
CID 155015110
5-(dimethylamino)-N,N,3-trimethyl-5-sulfanylidenepentanamide
CID 12500633
N,N-dimethylpent-4-enamide
CID 13308678
3,4-dihydroxy-N,N-dimethylbutanamide
CID 21025486

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethylpent-4-enamide?
The IUPAC name of N,N,3-trimethylpent-4-enamide (CID 10654310) is N,N,3-trimethylpent-4-enamide.
What is the SMILES notation for N,N,3-trimethylpent-4-enamide?
The canonical SMILES for N,N,3-trimethylpent-4-enamide is C=CC(C)CC(=O)N(C)C.
What is the InChIKey of N,N,3-trimethylpent-4-enamide?
The InChIKey is DPFNHNJNPIFMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-7(2)6-8(10)9(3)4/h5,7H,1,6H2,2-4H3.
What are the key properties of N,N,3-trimethylpent-4-enamide?
N,N,3-trimethylpent-4-enamide has a molecular weight of 141.21 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethylpent-4-enamide is sourced from PubChem (CID 10654310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).