N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide

C19H21ClN2O4 — CID 55799038

IUPACN-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)cc1OC
InChIInChI=1S/C19H21ClN2O4/c1-4-18(23)21-13-7-8-14(20)15(11-13)22-19(24)12-6-9-16(26-5-2)17(10-12)25-3/h6-11H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyLEPXFZVKXRIMOV-UHFFFAOYSA-N
MW376.84 g/mol
LogP4.35
Rot. Bonds7

About N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide

N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide (PubChem CID 55799038) has the molecular formula C19H21ClN2O4 and a molecular weight of 376.84 g/mol. Its IUPAC name is N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide
PubChem CID55799038
Molecular FormulaC19H21ClN2O4
Molecular Weight376.84 g/mol
Exact Mass376.12
IUPAC NameN-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)cc1OC
InChIInChI=1S/C19H21ClN2O4/c1-4-18(23)21-13-7-8-14(20)15(11-13)22-19(24)12-6-9-16(26-5-2)17(10-12)25-3/h6-11H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyLEPXFZVKXRIMOV-UHFFFAOYSA-N
XLogP4.35
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.84
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-chloro-5-(methylcarbamoyl)phenyl]-4-ethoxy-3-methoxybenzamide
CID 87004486
N-(3-chloro-4-methylphenyl)-4-ethoxy-3-methoxybenzamide
CID 3894156
1-N,4-N-bis(4-ethoxy-3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 24645019
N-[2-chloro-5-(propanoylamino)phenyl]-4-ethylbenzamide
CID 2995153
N-[2-chloro-5-(propanoylamino)phenyl]-4-pentoxybenzamide
CID 55799104
N-(5-acetamido-2-chlorophenyl)-4-(difluoromethoxy)-3-methoxybenzamide
CID 55916592
4-ethoxy-3-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 26698623
N-(4-ethoxy-3-methoxyphenyl)-3-oxobutanamide
CID 18072376
N-(5-acetamido-2-chlorophenyl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 55915712
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
N-(3-acetamidophenyl)-4-ethoxy-3-methoxybenzamide
CID 26103493
4-ethoxy-N-(2-ethoxy-4-methylphenyl)-3-methoxybenzamide
CID 87027059

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide?
The IUPAC name of N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide (CID 55799038) is N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide.
What is the SMILES notation for N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide?
The canonical SMILES for N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide is CCOc1ccc(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)cc1OC.
What is the InChIKey of N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide?
The InChIKey is LEPXFZVKXRIMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4/c1-4-18(23)21-13-7-8-14(20)15(11-13)22-19(24)12-6-9-16(26-5-2)17(10-12)25-3/h6-11H,4-5H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide?
N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide has a molecular weight of 376.84 g/mol, XLogP of 4.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(propanoylamino)phenyl]-4-ethoxy-3-methoxybenzamide is sourced from PubChem (CID 55799038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).