4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide

C16H16ClNO3 — CID 17362963

IUPAC4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide
SMILESCCOc1cc(Cl)ccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C16H16ClNO3/c1-3-21-15-9-11(17)7-8-14(15)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyROFQEQKCDNOPRD-UHFFFAOYSA-N
MW305.76 g/mol
LogP4.00
Rot. Bonds5

About 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide

4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide (PubChem CID 17362963) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide
PubChem CID17362963
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC Name4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide
SMILESCCOc1cc(Cl)ccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C16H16ClNO3/c1-3-21-15-9-11(17)7-8-14(15)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyROFQEQKCDNOPRD-UHFFFAOYSA-N
XLogP4.00
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
4-chloro-N-(3-ethoxyphenyl)-2-fluorobenzamide
CID 47311708
2,4-dimethoxy-N-(3-propoxyphenyl)benzamide
CID 34372962
2,4-diethoxy-N-(3-prop-2-enoxyphenyl)benzamide
CID 17086764
4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
CID 110762258
2-(2-ethoxyethoxy)-N-(3-methoxyphenyl)benzamide
CID 17122713
N-(3-chlorophenyl)-2-hydroxy-4-methoxybenzamide
CID 5274047
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
2-fluoro-4-methoxy-N-(3-propoxyphenyl)benzamide
CID 86981158
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate
CID 46416869
2-fluoro-4-methoxy-N-[3-(2-methoxyethoxy)phenyl]benzamide
CID 87026628

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide (CID 17362963) is 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide is CCOc1cc(Cl)ccc1C(=O)Nc1cccc(OC)c1.
What is the InChIKey of 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide?
The InChIKey is ROFQEQKCDNOPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-3-21-15-9-11(17)7-8-14(15)16(19)18-12-5-4-6-13(10-12)20-2/h4-10H,3H2,1-2H3,(H,18,19).
What are the key properties of 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide?
4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide has a molecular weight of 305.76 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 17362963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).