N,4-dimethylhex-5-enamide

C8H15NO — CID 155715427

IUPACN,4-dimethylhex-5-enamide
SMILESC=CC(C)CCC(=O)NC
InChIInChI=1S/C8H15NO/c1-4-7(2)5-6-8(10)9-3/h4,7H,1,5-6H2,2-3H3,(H,9,10)
InChIKeyDGGYWYIBKNMCQH-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.33
Rot. Bonds4

About N,4-dimethylhex-5-enamide

N,4-dimethylhex-5-enamide (PubChem CID 155715427) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N,4-dimethylhex-5-enamide.

Molecular Properties

Compound NameN,4-dimethylhex-5-enamide
PubChem CID155715427
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN,4-dimethylhex-5-enamide
SMILESC=CC(C)CCC(=O)NC
InChIInChI=1S/C8H15NO/c1-4-7(2)5-6-8(10)9-3/h4,7H,1,5-6H2,2-3H3,(H,9,10)
InChIKeyDGGYWYIBKNMCQH-UHFFFAOYSA-N
XLogP1.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.33
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

N,5-dimethylhepta-1,6-dien-2-amine
CID 155584945
methyl (6R)-6-methyl-3-oxooct-7-enoate
CID 134731255
N-[(3S)-3-methylpent-4-enyl]propanamide
CID 138511725
3-(hex-5-en-2-ylamino)-N-methylpropanamide
CID 104581947
carbonic acid;3-methylhex-1-ene
CID 161181273
N,7-dimethyloctanamide;molecular hydrogen
CID 164603110
N,N'-dimethylheptanediamide
CID 15166696
N-ethyl-5-methylhept-6-en-2-imine
CID 126728063
6-methyloct-7-enoate
CID 140706101
N',2-dimethylpentanediamide
CID 21268064
4-amino-N,5-dimethylhexanamide
CID 102537827
N,5-dimethylhept-6-en-2-amine
CID 138518123

Frequently Asked Questions

What is the IUPAC name of N,4-dimethylhex-5-enamide?
The IUPAC name of N,4-dimethylhex-5-enamide (CID 155715427) is N,4-dimethylhex-5-enamide.
What is the SMILES notation for N,4-dimethylhex-5-enamide?
The canonical SMILES for N,4-dimethylhex-5-enamide is C=CC(C)CCC(=O)NC.
What is the InChIKey of N,4-dimethylhex-5-enamide?
The InChIKey is DGGYWYIBKNMCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-7(2)5-6-8(10)9-3/h4,7H,1,5-6H2,2-3H3,(H,9,10).
What are the key properties of N,4-dimethylhex-5-enamide?
N,4-dimethylhex-5-enamide has a molecular weight of 141.21 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethylhex-5-enamide is sourced from PubChem (CID 155715427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).