4-chloro-2-ethoxybenzamide

C9H10ClNO2 — CID 126998915

IUPAC4-chloro-2-ethoxybenzamide
SMILESCCOc1cc(Cl)ccc1C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-2-13-8-5-6(10)3-4-7(8)9(11)12/h3-5H,2H2,1H3,(H2,11,12)
InChIKeyDSKNXMKSSFEEHX-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.84
Rot. Bonds3

About 4-chloro-2-ethoxybenzamide

4-chloro-2-ethoxybenzamide (PubChem CID 126998915) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 4-chloro-2-ethoxybenzamide.

Molecular Properties

Compound Name4-chloro-2-ethoxybenzamide
PubChem CID126998915
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name4-chloro-2-ethoxybenzamide
SMILESCCOc1cc(Cl)ccc1C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-2-13-8-5-6(10)3-4-7(8)9(11)12/h3-5H,2H2,1H3,(H2,11,12)
InChIKeyDSKNXMKSSFEEHX-UHFFFAOYSA-N
XLogP1.84
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-diethoxybenzamide
CID 17145726
methyl 2-(2-carbamoyl-5-chlorophenoxy)acetate
CID 47083412
4-chloro-2-[2-(methylamino)ethoxy]benzamide
CID 63082636
4-chloro-2-methoxybenzamide
CID 19741766
4-chloro-2-[2-(propan-2-ylamino)ethoxy]benzamide
CID 63083330
2-chloro-4,5-diethoxybenzamide
CID 82268164
3-[(4-chloro-2-ethoxybenzoyl)amino]propanoic acid
CID 120515164
4-chloro-2-[(4-cyanophenyl)methoxy]benzamide
CID 47467976
ethyl 4-carbamoyl-2-ethoxybenzoate
CID 132570188
2-[3-(4-chlorophenoxy)propoxy]-4-methoxybenzamide
CID 18198727
4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide
CID 107709587
(2-carbamoyl-5-methoxyphenyl) 2-(2,5-dichlorophenoxy)acetate
CID 18272979

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethoxybenzamide?
The IUPAC name of 4-chloro-2-ethoxybenzamide (CID 126998915) is 4-chloro-2-ethoxybenzamide.
What is the SMILES notation for 4-chloro-2-ethoxybenzamide?
The canonical SMILES for 4-chloro-2-ethoxybenzamide is CCOc1cc(Cl)ccc1C(N)=O.
What is the InChIKey of 4-chloro-2-ethoxybenzamide?
The InChIKey is DSKNXMKSSFEEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-2-13-8-5-6(10)3-4-7(8)9(11)12/h3-5H,2H2,1H3,(H2,11,12).
What are the key properties of 4-chloro-2-ethoxybenzamide?
4-chloro-2-ethoxybenzamide has a molecular weight of 199.64 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethoxybenzamide is sourced from PubChem (CID 126998915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).