2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide

C9H19N3 — CID 169107281

IUPAC2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide
SMILESC=C/N=C(\CN(C)C)N(C)CC
InChIInChI=1S/C9H19N3/c1-6-10-9(8-11(3)4)12(5)7-2/h6H,1,7-8H2,2-5H3/b10-9+
InChIKeyATDHWZPTELRRIR-MDZDMXLPSA-N
MW169.27 g/mol
LogP1.04
Rot. Bonds4

About 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide

2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide (PubChem CID 169107281) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide.

Molecular Properties

Compound Name2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide
PubChem CID169107281
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide
SMILESC=C/N=C(\CN(C)C)N(C)CC
InChIInChI=1S/C9H19N3/c1-6-10-9(8-11(3)4)12(5)7-2/h6H,1,7-8H2,2-5H3/b10-9+
InChIKeyATDHWZPTELRRIR-MDZDMXLPSA-N
XLogP1.04
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

(2Z)-N'-ethenyl-N-ethyl-N-methylpenta-2,4-dienimidamide
CID 166999090
N-ethyl-N-methylbuta-1,3-dien-2-amine
CID 123199652
[ethenyl-(N-ethenyl-C-ethylcarbonimidoyl)amino] thiohypoiodite
CID 153398429
(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine
CID 142124132
[1-(dimethylamino)-1-ethenyliminobutan-2-ylidene]tungsten
CID 158899138
ethane;prop-2-enyl N-ethyl-N-methylcarbamate
CID 142891984
1-ethyl-1-methyl-3-prop-2-enylurea
CID 115603850
N-ethyl-N-methylbut-3-enamide
CID 23466641
1-ethyl-3-(hydroxymethyl)-1,3-dimethyl-2-[(E)-prop-1-enyl]guanidine
CID 118490025
N'-ethenyl-N,N-dimethylprop-2-enimidamide
CID 143598460
ethane;N-ethyl-N-methylbut-3-enamide
CID 142224309
1-ethyl-1,3-dimethyl-3-prop-2-enylurea
CID 116657053

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide?
The IUPAC name of 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide (CID 169107281) is 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide.
What is the SMILES notation for 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide?
The canonical SMILES for 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide is C=C/N=C(\CN(C)C)N(C)CC.
What is the InChIKey of 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide?
The InChIKey is ATDHWZPTELRRIR-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H19N3/c1-6-10-9(8-11(3)4)12(5)7-2/h6H,1,7-8H2,2-5H3/b10-9+.
What are the key properties of 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide?
2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide has a molecular weight of 169.27 g/mol, XLogP of 1.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N'-ethenyl-N-ethyl-N-methylethanimidamide is sourced from PubChem (CID 169107281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).