(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide

C11H11Cl2NO2 — CID 97305734

IUPAC(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide
SMILESCON(C)C(=O)/C=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C11H11Cl2NO2/c1-14(16-2)10(15)7-6-8-4-3-5-9(12)11(8)13/h3-7H,1-2H3/b7-6-
InChIKeyHEICTZIWUQNDDN-SREVYHEPSA-N
MW260.12 g/mol
LogP3.03
Rot. Bonds3

About (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide

(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide (PubChem CID 97305734) has the molecular formula C11H11Cl2NO2 and a molecular weight of 260.12 g/mol. Its IUPAC name is (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide
PubChem CID97305734
Molecular FormulaC11H11Cl2NO2
Molecular Weight260.12 g/mol
Exact Mass259.02
IUPAC Name(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide
SMILESCON(C)C(=O)/C=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C11H11Cl2NO2/c1-14(16-2)10(15)7-6-8-4-3-5-9(12)11(8)13/h3-7H,1-2H3/b7-6-
InChIKeyHEICTZIWUQNDDN-SREVYHEPSA-N
XLogP3.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.12
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2,3-dichlorophenyl)-N-(2-hydroxypropyl)-N-methylprop-2-enamide
CID 76940070
(E)-3-(2,3-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]-N-methylprop-2-enamide
CID 39972101
(Z)-3-(2,3-dichlorophenyl)prop-2-enoic acid
CID 2412390
(E)-3-(2,3-dichlorophenyl)prop-2-enoate
CID 2063719
ethyl 2-[[(E)-3-(2,3-dichlorophenyl)prop-2-enoyl]-ethylamino]acetate
CID 61013050
3-(2,3-dichlorophenyl)-N-[(3-hydroxycyclobutyl)methyl]-N-methylprop-2-enamide
CID 77109035
3-(2,3-dichlorophenyl)-N-(1-methoxypropan-2-yl)prop-2-enamide
CID 75616541
2-[[(E)-3-(2,3-dichlorophenyl)prop-2-enoyl]-propylamino]acetic acid
CID 61013143
(E)-N-cyclobutyl-3-(2,3-dichlorophenyl)-N-(2-hydroxyethyl)prop-2-enamide
CID 102684628
ethane;(E)-N-methoxy-N-methyl-3-(2,2,3,3-tetrahydroxy-1-benzofuran-4-yl)prop-2-enamide
CID 145115896
3-(2,3-dichlorophenyl)-1-(2-methylphenyl)prop-2-en-1-one
CID 4851047
(E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(2,3-dichlorophenyl)-N-methylprop-2-enamide
CID 9392949

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide?
The IUPAC name of (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide (CID 97305734) is (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide.
What is the SMILES notation for (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide?
The canonical SMILES for (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide is CON(C)C(=O)/C=C\c1cccc(Cl)c1Cl.
What is the InChIKey of (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide?
The InChIKey is HEICTZIWUQNDDN-SREVYHEPSA-N. The full InChI is InChI=1S/C11H11Cl2NO2/c1-14(16-2)10(15)7-6-8-4-3-5-9(12)11(8)13/h3-7H,1-2H3/b7-6-.
What are the key properties of (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide?
(Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide has a molecular weight of 260.12 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(2,3-dichlorophenyl)-N-methoxy-N-methylprop-2-enamide is sourced from PubChem (CID 97305734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).