(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide

C9H17N3O — CID 143941192

IUPAC(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide
SMILESC/C=N\N/C(C(=O)NC)=C(\C)CC
InChIInChI=1S/C9H17N3O/c1-5-7(3)8(9(13)10-4)12-11-6-2/h6,12H,5H2,1-4H3,(H,10,13)/b8-7+,11-6-
InChIKeyMUQRHENIGJWLDG-UTGOSBLHSA-N
MW183.25 g/mol
LogP1.01
Rot. Bonds4

About (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide

(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide (PubChem CID 143941192) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide.

Molecular Properties

Compound Name(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide
PubChem CID143941192
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide
SMILESC/C=N\N/C(C(=O)NC)=C(\C)CC
InChIInChI=1S/C9H17N3O/c1-5-7(3)8(9(13)10-4)12-11-6-2/h6,12H,5H2,1-4H3,(H,10,13)/b8-7+,11-6-
InChIKeyMUQRHENIGJWLDG-UTGOSBLHSA-N
XLogP1.01
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-2-[(2Z)-2-ethylidenehydrazinyl]-3-methylpent-2-enamide
CID 143941275
(Z)-N-[(Z)-ethylideneamino]-1-ethylsulfanyl-2-methylbut-1-en-1-amine
CID 143941334
N,3-dimethyl-2-propylpent-2-enamide
CID 175801698
N'-amino-N-[(Z)-ethylideneamino]propanimidamide
CID 174020108
ethane;N-methyl-2-oxobutanamide
CID 143884065
N-[(Z)-ethylideneamino]-2,2-dimethylpropanamide
CID 130468433
(3E,5E)-5-chloro-N,3-dimethylocta-3,5-dien-4-amine
CID 171794714
N,N'-di((113C)methyl)oxamide
CID 169438737
(Z)-2-ethyl-N-methylpent-2-enamide
CID 177053955
[(E)-1-[(2Z)-2-ethylidenehydrazinyl]-1-oxobut-2-en-2-yl] (Z)-2-(2-methylhydrazinyl)but-2-enoate
CID 139293874
N-[(Z)-ethylideneamino]-N'-methylethanimidamide
CID 89218038
1-[(E)-butan-2-ylideneamino]-3-methylurea
CID 55220205

Frequently Asked Questions

What is the IUPAC name of (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide?
The IUPAC name of (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide (CID 143941192) is (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide.
What is the SMILES notation for (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide?
The canonical SMILES for (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide is C/C=N\N/C(C(=O)NC)=C(\C)CC.
What is the InChIKey of (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide?
The InChIKey is MUQRHENIGJWLDG-UTGOSBLHSA-N. The full InChI is InChI=1S/C9H17N3O/c1-5-7(3)8(9(13)10-4)12-11-6-2/h6,12H,5H2,1-4H3,(H,10,13)/b8-7+,11-6-.
What are the key properties of (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide?
(E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide has a molecular weight of 183.25 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-[(2Z)-2-ethylidenehydrazinyl]-N,3-dimethylpent-2-enamide is sourced from PubChem (CID 143941192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).