N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide

C18H20ClNO2 — CID 18169494

IUPACN-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide
SMILESCCCC(C(=O)Nc1cc(Cl)ccc1OC)c1ccccc1
InChIInChI=1S/C18H20ClNO2/c1-3-7-15(13-8-5-4-6-9-13)18(21)20-16-12-14(19)10-11-17(16)22-2/h4-6,8-12,15H,3,7H2,1-2H3,(H,20,21)
InChIKeyGRVYFQQARCNZON-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.87
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide

N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide (PubChem CID 18169494) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide
PubChem CID18169494
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide
SMILESCCCC(C(=O)Nc1cc(Cl)ccc1OC)c1ccccc1
InChIInChI=1S/C18H20ClNO2/c1-3-7-15(13-8-5-4-6-9-13)18(21)20-16-12-14(19)10-11-17(16)22-2/h4-6,8-12,15H,3,7H2,1-2H3,(H,20,21)
InChIKeyGRVYFQQARCNZON-UHFFFAOYSA-N
XLogP4.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide (CID 18169494) is N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide is CCCC(C(=O)Nc1cc(Cl)ccc1OC)c1ccccc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide?
The InChIKey is GRVYFQQARCNZON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-3-7-15(13-8-5-4-6-9-13)18(21)20-16-12-14(19)10-11-17(16)22-2/h4-6,8-12,15H,3,7H2,1-2H3,(H,20,21).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide?
N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide has a molecular weight of 317.82 g/mol, XLogP of 4.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-phenylpentanamide is sourced from PubChem (CID 18169494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).