N-[2-(4-hydroxyphenyl)ethyl]pentanamide

C13H19NO2 — CID 11106930

IUPACN-[2-(4-hydroxyphenyl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C13H19NO2/c1-2-3-4-13(16)14-10-9-11-5-7-12(15)8-6-11/h5-8,15H,2-4,9-10H2,1H3,(H,14,16)
InChIKeyPCOQWVBCOWOSPT-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.24
Rot. Bonds6

About N-[2-(4-hydroxyphenyl)ethyl]pentanamide

N-[2-(4-hydroxyphenyl)ethyl]pentanamide (PubChem CID 11106930) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]pentanamide
PubChem CID11106930
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1ccc(O)cc1
InChIInChI=1S/C13H19NO2/c1-2-3-4-13(16)14-10-9-11-5-7-12(15)8-6-11/h5-8,15H,2-4,9-10H2,1H3,(H,14,16)
InChIKeyPCOQWVBCOWOSPT-UHFFFAOYSA-N
XLogP2.24
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]pentanamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]pentanamide (CID 11106930) is N-[2-(4-hydroxyphenyl)ethyl]pentanamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]pentanamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]pentanamide is CCCCC(=O)NCCc1ccc(O)cc1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]pentanamide?
The InChIKey is PCOQWVBCOWOSPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-2-3-4-13(16)14-10-9-11-5-7-12(15)8-6-11/h5-8,15H,2-4,9-10H2,1H3,(H,14,16).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]pentanamide?
N-[2-(4-hydroxyphenyl)ethyl]pentanamide has a molecular weight of 221.30 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]pentanamide is sourced from PubChem (CID 11106930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).