N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide

C20H21N3O4 — CID 47923812

IUPACN'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide
SMILESO=C(NNC(=O)C1CCCN1C(=O)Cc1ccccc1)c1ccccc1O
InChIInChI=1S/C20H21N3O4/c24-17-11-5-4-9-15(17)19(26)21-22-20(27)16-10-6-12-23(16)18(25)13-14-7-2-1-3-8-14/h1-5,7-9,11,16,24H,6,10,12-13H2,(H,21,26)(H,22,27)
InChIKeyUQFZXECKGJWLDQ-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.39
Rot. Bonds4

About N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide

N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide (PubChem CID 47923812) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide
PubChem CID47923812
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC NameN'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide
SMILESO=C(NNC(=O)C1CCCN1C(=O)Cc1ccccc1)c1ccccc1O
InChIInChI=1S/C20H21N3O4/c24-17-11-5-4-9-15(17)19(26)21-22-20(27)16-10-6-12-23(16)18(25)13-14-7-2-1-3-8-14/h1-5,7-9,11,16,24H,6,10,12-13H2,(H,21,26)(H,22,27)
InChIKeyUQFZXECKGJWLDQ-UHFFFAOYSA-N
XLogP1.39
TPSA98.74 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyphenyl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47923867
(2S)-N-(2-hydroxyphenyl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95216209
N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47164597
N-[(3,4-dihydroxyphenyl)methyl]-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 136521380
(2R)-N-cycloheptyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95190248
(2R)-1-(2-phenylacetyl)-N-[4-[(E)-2-[4-[[(2R)-1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]phenyl]ethenyl]phenyl]pyrrolidine-2-carboxamide
CID 53326825
4-[[[1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]methyl]benzoic acid
CID 119353518
(2S)-N-oxo-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 89035815
N-(1-cyclopropylpiperidin-4-yl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47881551
(2S)-N-[(2R)-2-cyanopropyl]-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95765004
N-phenyl-1-[2-[(2-phenylacetyl)amino]acetyl]pyrrolidine-2-carboxamide
CID 119032269
(2S)-N-[4-[2-(4-benzamidophenyl)ethenyl]phenyl]-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 91593146

Frequently Asked Questions

What is the IUPAC name of N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide?
The IUPAC name of N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide (CID 47923812) is N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide.
What is the SMILES notation for N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide?
The canonical SMILES for N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide is O=C(NNC(=O)C1CCCN1C(=O)Cc1ccccc1)c1ccccc1O.
What is the InChIKey of N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide?
The InChIKey is UQFZXECKGJWLDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c24-17-11-5-4-9-15(17)19(26)21-22-20(27)16-10-6-12-23(16)18(25)13-14-7-2-1-3-8-14/h1-5,7-9,11,16,24H,6,10,12-13H2,(H,21,26)(H,22,27).
What are the key properties of N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide?
N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide has a molecular weight of 367.41 g/mol, XLogP of 1.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-hydroxybenzoyl)-1-(2-phenylacetyl)pyrrolidine-2-carbohydrazide is sourced from PubChem (CID 47923812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).