N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide

C19H22ClNO3 — CID 2563930

IUPACN-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OCC)cc1
InChIInChI=1S/C19H22ClNO3/c1-3-5-6-19(22)21-17-13-14(20)7-12-18(17)24-16-10-8-15(9-11-16)23-4-2/h7-13H,3-6H2,1-2H3,(H,21,22)
InChIKeyVPNQVEYNMAUDNU-UHFFFAOYSA-N
MW347.84 g/mol
LogP5.66
Rot. Bonds8

About N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide

N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide (PubChem CID 2563930) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide.

Molecular Properties

Compound NameN-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide
PubChem CID2563930
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC NameN-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OCC)cc1
InChIInChI=1S/C19H22ClNO3/c1-3-5-6-19(22)21-17-13-14(20)7-12-18(17)24-16-10-8-15(9-11-16)23-4-2/h7-13H,3-6H2,1-2H3,(H,21,22)
InChIKeyVPNQVEYNMAUDNU-UHFFFAOYSA-N
XLogP5.66
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.84
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-butyl-2,4,5-trioxoimidazolidin-1-yl)-N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]acetamide
CID 55468975
4-chloro-N-(5-chloro-2-ethoxyphenyl)butanamide
CID 63308071
N-(5-chloro-2-ethoxyphenyl)butanamide
CID 61062519
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-3-ethoxypropanamide
CID 56501217
3-amino-N-(5-chloro-2-ethoxyphenyl)propanamide
CID 60927898
3-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-oxoethoxy]benzamide
CID 55733911
2-[2-[5-chloro-2-(4-ethoxyphenoxy)anilino]-2-oxoethoxy]-4-methylbenzamide
CID 24585455
N-[5-chloro-2-(4-methylphenoxy)phenyl]-4-(2-methoxyethoxy)butanamide
CID 60567428
N-(5-chloro-2-methoxyphenyl)-4-(4-ethylphenoxy)butanamide
CID 19184672
4-amino-N-(5-chloro-2-propoxyphenyl)butanamide
CID 54862408
N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-2-(4-oxoquinolin-1-yl)acetamide
CID 60586135
4-(4-chlorophenyl)sulfanyl-N-(2,5-diethoxyphenyl)butanamide
CID 16549738

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide?
The IUPAC name of N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide (CID 2563930) is N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide.
What is the SMILES notation for N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide?
The canonical SMILES for N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide is CCCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OCC)cc1.
What is the InChIKey of N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide?
The InChIKey is VPNQVEYNMAUDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-3-5-6-19(22)21-17-13-14(20)7-12-18(17)24-16-10-8-15(9-11-16)23-4-2/h7-13H,3-6H2,1-2H3,(H,21,22).
What are the key properties of N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide?
N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide has a molecular weight of 347.84 g/mol, XLogP of 5.66, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]pentanamide is sourced from PubChem (CID 2563930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).