N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide

C16H16ClNO3 — CID 2897418

IUPACN-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(OC)c1ccccc1
InChIInChI=1S/C16H16ClNO3/c1-20-14-9-8-12(17)10-13(14)18-16(19)15(21-2)11-6-4-3-5-7-11/h3-10,15H,1-2H3,(H,18,19)
InChIKeyDTVUHKBSONUYRD-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.67
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide

N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide (PubChem CID 2897418) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
PubChem CID2897418
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(OC)c1ccccc1
InChIInChI=1S/C16H16ClNO3/c1-20-14-9-8-12(17)10-13(14)18-16(19)15(21-2)11-6-4-3-5-7-11/h3-10,15H,1-2H3,(H,18,19)
InChIKeyDTVUHKBSONUYRD-UHFFFAOYSA-N
XLogP3.67
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 ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide (CID 2897418) is N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide is COc1ccc(Cl)cc1NC(=O)C(OC)c1ccccc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide?
The InChIKey is DTVUHKBSONUYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-14-9-8-12(17)10-13(14)18-16(19)15(21-2)11-6-4-3-5-7-11/h3-10,15H,1-2H3,(H,18,19).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide?
N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide has a molecular weight of 305.76 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 2897418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).