2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide

C15H22N2O2 — CID 62992551

IUPAC2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide
SMILESO=C(Cc1cccc(O)c1)NCCCN1CCCC1
InChIInChI=1S/C15H22N2O2/c18-14-6-3-5-13(11-14)12-15(19)16-7-4-10-17-8-1-2-9-17/h3,5-6,11,18H,1-2,4,7-10,12H2,(H,16,19)
InChIKeyLQSZWPFFUZZRBV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.54
Rot. Bonds6

About 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide

2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide (PubChem CID 62992551) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide
PubChem CID62992551
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide
SMILESO=C(Cc1cccc(O)c1)NCCCN1CCCC1
InChIInChI=1S/C15H22N2O2/c18-14-6-3-5-13(11-14)12-15(19)16-7-4-10-17-8-1-2-9-17/h3,5-6,11,18H,1-2,4,7-10,12H2,(H,16,19)
InChIKeyLQSZWPFFUZZRBV-UHFFFAOYSA-N
XLogP1.54
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 ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(azepan-1-yl)propyl]-2-(2,6-dichlorophenyl)acetamide
CID 112764661
2-(3-aminophenyl)-N-(2-piperidin-1-ylethyl)acetamide
CID 62500018
2-(3-hydroxyphenyl)-N-[3-(methylamino)propyl]acetamide
CID 61399440
2-phenyl-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 975347
N-(6-chlorohexyl)-2-(3-hydroxyphenyl)acetamide
CID 107846976
1-(3-hydroxyphenyl)-3-pyrrolidin-1-ylpropan-2-one
CID 141149374
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-2-(3-hydroxyphenyl)acetamide
CID 115603539
N-[3-(azepan-1-yl)propyl]-2-(4-methoxy-3-methylphenyl)acetamide
CID 100689280
2-(4-methoxyphenyl)-N-(3-piperidin-1-ylpropyl)acetamide
CID 92674422
3-hydroxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 43236314
1-[2-(3-hydroxyphenyl)ethyl]-3-(4-morpholin-4-ylbutyl)urea
CID 99816188
2-(3-methoxyphenyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide
CID 38448767

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide?
The IUPAC name of 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide (CID 62992551) is 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide.
What is the SMILES notation for 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide?
The canonical SMILES for 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide is O=C(Cc1cccc(O)c1)NCCCN1CCCC1.
What is the InChIKey of 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide?
The InChIKey is LQSZWPFFUZZRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-14-6-3-5-13(11-14)12-15(19)16-7-4-10-17-8-1-2-9-17/h3,5-6,11,18H,1-2,4,7-10,12H2,(H,16,19).
What are the key properties of 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide?
2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-N-(3-pyrrolidin-1-ylpropyl)acetamide is sourced from PubChem (CID 62992551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).