4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide

C19H19ClN2O3 — CID 17312287

IUPAC4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C19H19ClN2O3/c1-11(23)21-17-10-18(25-2)15(9-16(17)20)19(24)22-14-7-6-12-4-3-5-13(12)8-14/h6-10H,3-5H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyDYALLRCQHYQEQU-UHFFFAOYSA-N
MW358.83 g/mol
LogP4.05
Rot. Bonds4

About 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide

4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide (PubChem CID 17312287) has the molecular formula C19H19ClN2O3 and a molecular weight of 358.83 g/mol. Its IUPAC name is 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide.

Molecular Properties

Compound Name4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide
PubChem CID17312287
Molecular FormulaC19H19ClN2O3
Molecular Weight358.83 g/mol
Exact Mass358.11
IUPAC Name4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C19H19ClN2O3/c1-11(23)21-17-10-18(25-2)15(9-16(17)20)19(24)22-14-7-6-12-4-3-5-13(12)8-14/h6-10H,3-5H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyDYALLRCQHYQEQU-UHFFFAOYSA-N
XLogP4.05
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.83
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1H-inden-5-yl)-2-methoxy-4-methylsulfanylbenzamide
CID 2124983
N-(2,3-dihydro-1H-inden-5-yl)-2,3-dimethoxybenzamide
CID 26198866
4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide
CID 17257142
4-acetamido-5-chloro-2-methoxy-N-(2-methylphenyl)benzamide
CID 17257138
methyl 2-[(4-acetamido-5-chloro-2-methoxybenzoyl)amino]benzoate
CID 2988921
4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide
CID 17257106
N-(2-chloro-4,5-dimethoxyphenyl)acetamide
CID 60709552
4-acetamido-5-chloro-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 154085397
2-chloro-N-(2,3-dihydro-1H-inden-5-yl)-4-fluorobenzamide
CID 6470489
4-acetamido-5-chloro-2-methoxy-N-(3-oxoprop-1-en-2-yl)benzamide
CID 10613903
4-acetamido-5-chloro-2-methoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 6490620
4-acetamido-5-chloro-2-methoxy-N-[(4-methoxyphenyl)methyl]benzamide
CID 17257105

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide?
The IUPAC name of 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide (CID 17312287) is 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide.
What is the SMILES notation for 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide?
The canonical SMILES for 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide is COc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1ccc2c(c1)CCC2.
What is the InChIKey of 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide?
The InChIKey is DYALLRCQHYQEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O3/c1-11(23)21-17-10-18(25-2)15(9-16(17)20)19(24)22-14-7-6-12-4-3-5-13(12)8-14/h6-10H,3-5H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide?
4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide has a molecular weight of 358.83 g/mol, XLogP of 4.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-5-chloro-N-(2,3-dihydro-1H-inden-5-yl)-2-methoxybenzamide is sourced from PubChem (CID 17312287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).