2-(dimethylamino)-4-methylpent-4-enamide

C8H16N2O — CID 13149597

IUPAC2-(dimethylamino)-4-methylpent-4-enamide
SMILESC=C(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C8H16N2O/c1-6(2)5-7(8(9)11)10(3)4/h7H,1,5H2,2-4H3,(H2,9,11)
InChIKeySHKHAMHXXCRBKF-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.37
Rot. Bonds4

About 2-(dimethylamino)-4-methylpent-4-enamide

2-(dimethylamino)-4-methylpent-4-enamide (PubChem CID 13149597) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-(dimethylamino)-4-methylpent-4-enamide.

Molecular Properties

Compound Name2-(dimethylamino)-4-methylpent-4-enamide
PubChem CID13149597
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-(dimethylamino)-4-methylpent-4-enamide
SMILESC=C(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C8H16N2O/c1-6(2)5-7(8(9)11)10(3)4/h7H,1,5H2,2-4H3,(H2,9,11)
InChIKeySHKHAMHXXCRBKF-UHFFFAOYSA-N
XLogP0.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(dimethylamino)-2-methylidenepentanamide;2-methylprop-2-enamide
CID 175472051
N',2-dimethyl-3-(2-methylprop-2-enyl)butanediamide
CID 142005655
4-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-4-enoic acid
CID 130630611
(4S)-4-(dimethylamino)-5-oxohexanamide
CID 59048247
2-(dimethylamino)propanamide;2-methylprop-2-enoic acid
CID 175460965
1-methyl-1-(2-methylprop-2-enyl)urea
CID 115964716
4-hydroxy-2-propan-2-ylpent-4-enamide
CID 145216549
(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propanamide
CID 70366423
[2-(dimethylamino)-3-fluorobut-3-enyl] 2-methylprop-2-enoate
CID 175067527
diethyl 2-(dimethylamino)-4-methylidenepentanedioate
CID 121012578
(3R)-3-(dimethylamino)-4-hydroxybutan-2-one
CID 59048229
(3S)-3,5-dimethylhex-5-en-2-one
CID 45085211

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-4-methylpent-4-enamide?
The IUPAC name of 2-(dimethylamino)-4-methylpent-4-enamide (CID 13149597) is 2-(dimethylamino)-4-methylpent-4-enamide.
What is the SMILES notation for 2-(dimethylamino)-4-methylpent-4-enamide?
The canonical SMILES for 2-(dimethylamino)-4-methylpent-4-enamide is C=C(C)CC(C(N)=O)N(C)C.
What is the InChIKey of 2-(dimethylamino)-4-methylpent-4-enamide?
The InChIKey is SHKHAMHXXCRBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6(2)5-7(8(9)11)10(3)4/h7H,1,5H2,2-4H3,(H2,9,11).
What are the key properties of 2-(dimethylamino)-4-methylpent-4-enamide?
2-(dimethylamino)-4-methylpent-4-enamide has a molecular weight of 156.23 g/mol, XLogP of 0.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-4-methylpent-4-enamide is sourced from PubChem (CID 13149597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).