5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide

C15H22N2O2 — CID 79199227

IUPAC5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide
SMILESO=C(CCCCO)Nc1ccc(N2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c18-12-4-1-5-15(19)16-13-6-8-14(9-7-13)17-10-2-3-11-17/h6-9,18H,1-5,10-12H2,(H,16,19)
InChIKeySKIJNWCLOSDTSJ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.39
Rot. Bonds6

About 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide

5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide (PubChem CID 79199227) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide.

Molecular Properties

Compound Name5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide
PubChem CID79199227
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide
SMILESO=C(CCCCO)Nc1ccc(N2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c18-12-4-1-5-15(19)16-13-6-8-14(9-7-13)17-10-2-3-11-17/h6-9,18H,1-5,10-12H2,(H,16,19)
InChIKeySKIJNWCLOSDTSJ-UHFFFAOYSA-N
XLogP2.39
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 43701399
N-[4-(azepan-1-yl)phenyl]butanamide
CID 60593025
3-(4-pyrrolidin-1-ylanilino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109041751
N-(4-piperidin-1-ylphenyl)-3-(4-pyrrolidin-1-ylanilino)propanamide
CID 109041781
2-bromo-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 63680073
3-methylsulfanyl-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 18165019
3-(butylamino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109012504
3-acetamido-N-[4-(azepan-1-yl)phenyl]propanamide
CID 17462050
N-phenyl-3-(4-pyrrolidin-1-ylanilino)propanamide
CID 109033848
N-(4-fluorophenyl)-3-(4-pyrrolidin-1-ylanilino)propanamide
CID 109037669
4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 79200789
N-phenyl-3-(4-piperidin-1-ylanilino)propanamide
CID 109033849

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide?
The IUPAC name of 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide (CID 79199227) is 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide.
What is the SMILES notation for 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide?
The canonical SMILES for 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide is O=C(CCCCO)Nc1ccc(N2CCCC2)cc1.
What is the InChIKey of 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide?
The InChIKey is SKIJNWCLOSDTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-12-4-1-5-15(19)16-13-6-8-14(9-7-13)17-10-2-3-11-17/h6-9,18H,1-5,10-12H2,(H,16,19).
What are the key properties of 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide?
5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide has a molecular weight of 262.35 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide is sourced from PubChem (CID 79199227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).