4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide

C15H22N2O2 — CID 79200789

IUPAC4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide
SMILESO=C(CCCO)Nc1ccc(CN2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c18-11-3-4-15(19)16-14-7-5-13(6-8-14)12-17-9-1-2-10-17/h5-8,18H,1-4,9-12H2,(H,16,19)
InChIKeyBQHAZUGHHFMXOQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.99
Rot. Bonds6

About 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide

4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide (PubChem CID 79200789) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide.

Molecular Properties

Compound Name4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide
PubChem CID79200789
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide
SMILESO=C(CCCO)Nc1ccc(CN2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c18-11-3-4-15(19)16-14-7-5-13(6-8-14)12-17-9-1-2-10-17/h5-8,18H,1-4,9-12H2,(H,16,19)
InChIKeyBQHAZUGHHFMXOQ-UHFFFAOYSA-N
XLogP1.99
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 ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 3292281
3-bromo-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide
CID 108739357
1,3-bis[4-(pyrrolidin-1-ylmethyl)phenyl]urea
CID 17464843
3-(propan-2-ylamino)-N-[4-(pyrrolidin-1-ylmethyl)phenyl]propanamide
CID 60854515
4-amino-N-[4-(azepan-1-ylmethyl)phenyl]pentanamide
CID 120565116
4-(2-chlorophenoxy)-N-[4-(piperidin-1-ylmethyl)phenyl]butanamide
CID 108762073
4-(2,6-dimethylphenoxy)-N-[4-(piperidin-1-ylmethyl)phenyl]butanamide
CID 108762064
2-(propan-2-ylamino)-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 60671103
4-(4-fluorophenyl)-4-oxo-N-[4-(piperidin-1-ylmethyl)phenyl]butanamide
CID 108739319
5-hydroxy-N-(4-pyrrolidin-1-ylphenyl)pentanamide
CID 79199227
2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide
CID 43816897
1-[[4-(4-aminobutanoylamino)phenyl]methyl]piperidine-3-carboxamide;dihydrochloride
CID 119872164

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide?
The IUPAC name of 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide (CID 79200789) is 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide.
What is the SMILES notation for 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide?
The canonical SMILES for 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide is O=C(CCCO)Nc1ccc(CN2CCCC2)cc1.
What is the InChIKey of 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide?
The InChIKey is BQHAZUGHHFMXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-11-3-4-15(19)16-14-7-5-13(6-8-14)12-17-9-1-2-10-17/h5-8,18H,1-4,9-12H2,(H,16,19).
What are the key properties of 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide?
4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide has a molecular weight of 262.35 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide is sourced from PubChem (CID 79200789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).