N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide

C14H20ClNO2 — CID 110787710

IUPACN-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1cc(Cl)ccc1OC
InChIInChI=1S/C14H20ClNO2/c1-3-4-5-14(17)16-9-8-11-10-12(15)6-7-13(11)18-2/h6-7,10H,3-5,8-9H2,1-2H3,(H,16,17)
InChIKeyDBEOUFBIQYKFRD-UHFFFAOYSA-N
MW269.77 g/mol
LogP3.20
Rot. Bonds7

About N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide

N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide (PubChem CID 110787710) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide
PubChem CID110787710
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC NameN-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1cc(Cl)ccc1OC
InChIInChI=1S/C14H20ClNO2/c1-3-4-5-14(17)16-9-8-11-10-12(15)6-7-13(11)18-2/h6-7,10H,3-5,8-9H2,1-2H3,(H,16,17)
InChIKeyDBEOUFBIQYKFRD-UHFFFAOYSA-N
XLogP3.20
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[2-(2,5-dimethoxyphenyl)ethylamino]-2-oxoethyl]pentanamide
CID 110601119
2-(5-chloro-2-methoxyphenyl)ethylcarbamic acid
CID 115171089
4-amino-N-[2-(5-fluoro-2-methoxyphenyl)ethyl]butanamide
CID 115155399
2-[3-(5-chloro-2-methoxyphenyl)propanoylamino]acetic acid
CID 82043100
N-[2-(N-acetyl-5-chloro-2-methoxyanilino)ethyl]pentanamide
CID 113060271
N-[2-(5-chloro-2-methoxyphenyl)ethyl]-4-methoxybenzamide
CID 110787720
N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
CID 5073739
3-chloro-N-[(5-chloro-2-methoxyphenyl)methyl]propanamide
CID 82110952
1-(5-chloro-2-methoxyphenyl)undecan-2-one
CID 114968573
5-(5-chloro-2-methoxyphenyl)pentanoic acid
CID 93186212
4-acetamido-N-[2-(5-chloro-2-methoxyphenyl)ethyl]benzamide
CID 110795201
2-(5-chloro-2-methoxyphenyl)-N-(3-methylbutyl)acetamide
CID 110767257

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide?
The IUPAC name of N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide (CID 110787710) is N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide.
What is the SMILES notation for N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide?
The canonical SMILES for N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide is CCCCC(=O)NCCc1cc(Cl)ccc1OC.
What is the InChIKey of N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide?
The InChIKey is DBEOUFBIQYKFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-3-4-5-14(17)16-9-8-11-10-12(15)6-7-13(11)18-2/h6-7,10H,3-5,8-9H2,1-2H3,(H,16,17).
What are the key properties of N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide?
N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide has a molecular weight of 269.77 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-2-methoxyphenyl)ethyl]pentanamide is sourced from PubChem (CID 110787710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).