4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide

C20H23N3O3 — CID 119749178

IUPAC4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccc(NC(=O)C2CC(O)CN2)cc1
InChIInChI=1S/C20H23N3O3/c24-17-12-18(22-13-17)20(26)23-16-8-6-15(7-9-16)19(25)21-11-10-14-4-2-1-3-5-14/h1-9,17-18,22,24H,10-13H2,(H,21,25)(H,23,26)
InChIKeyOIYZSYOXXMOXSC-UHFFFAOYSA-N
MW353.42 g/mol
LogP1.32
Rot. Bonds6

About 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide

4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide (PubChem CID 119749178) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide
PubChem CID119749178
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccc(NC(=O)C2CC(O)CN2)cc1
InChIInChI=1S/C20H23N3O3/c24-17-12-18(22-13-17)20(26)23-16-8-6-15(7-9-16)19(25)21-11-10-14-4-2-1-3-5-14/h1-9,17-18,22,24H,10-13H2,(H,21,25)(H,23,26)
InChIKeyOIYZSYOXXMOXSC-UHFFFAOYSA-N
XLogP1.32
TPSA90.46 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 51.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(cyclopropylcarbamoyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide
CID 43703990
N-[4-(cyclopropylcarbamoyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119698538
N-[4-(2-phenylethylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 119303511
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
4-hydroxy-N-[4-(3,3,3-trifluoropropyl)phenyl]pyrrolidine-2-carboxamide
CID 119808841
(2S,4R)-N-benzyl-4-hydroxypyrrolidine-2-carboxamide
CID 15482052
4-hydroxy-N-[3-(propylcarbamoyl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119712065
N-(2-phenylethyl)-4-(3-phenylpropanoylamino)benzamide
CID 1296529
4-(cyclopropylcarbamoylamino)-N-(2-phenylethyl)benzamide
CID 39884786
4-iodo-N-(2-phenylethyl)benzamide
CID 1348743
4-hydroxy-N-(4-phenylbutan-2-yl)pyrrolidine-2-carboxamide
CID 61254438
N-[2-(4-fluorophenyl)ethyl]-4-[(2-phenylacetyl)amino]benzamide
CID 17119562

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide (CID 119749178) is 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide is O=C(NCCc1ccccc1)c1ccc(NC(=O)C2CC(O)CN2)cc1.
What is the InChIKey of 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide?
The InChIKey is OIYZSYOXXMOXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c24-17-12-18(22-13-17)20(26)23-16-8-6-15(7-9-16)19(25)21-11-10-14-4-2-1-3-5-14/h1-9,17-18,22,24H,10-13H2,(H,21,25)(H,23,26).
What are the key properties of 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide?
4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 1.32, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 119749178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).