N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride

C20H22ClN3O3 — CID 119761222

IUPACN-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)C1CC(O)CN1
InChIInChI=1S/C20H21N3O3.ClH/c24-16-11-17(21-12-16)19(25)22-15-6-3-5-14(10-15)20(26)23-9-8-13-4-1-2-7-18(13)23;/h1-7,10,16-17,21,24H,8-9,11-12H2,(H,22,25);1H
InChIKeyWQYRCBXZJQLISK-UHFFFAOYSA-N
MW387.87 g/mol
LogP1.97
Rot. Bonds3

About N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride

N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119761222) has the molecular formula C20H22ClN3O3 and a molecular weight of 387.87 g/mol. Its IUPAC name is N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
PubChem CID119761222
Molecular FormulaC20H22ClN3O3
Molecular Weight387.87 g/mol
Exact Mass387.13
IUPAC NameN-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)C1CC(O)CN1
InChIInChI=1S/C20H21N3O3.ClH/c24-16-11-17(21-12-16)19(25)22-15-6-3-5-14(10-15)20(26)23-9-8-13-4-1-2-7-18(13)23;/h1-7,10,16-17,21,24H,8-9,11-12H2,(H,22,25);1H
InChIKeyWQYRCBXZJQLISK-UHFFFAOYSA-N
XLogP1.97
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.87
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]acetamide
CID 26290520
N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide
CID 119866796
N-(3-bromophenyl)-4-hydroxypyrrolidine-2-carboxamide
CID 43120817
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]methanesulfonamide
CID 8001369
N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119310553
1-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-3-(2-hydroxyethyl)urea
CID 60614369
N-[3-(azepan-1-yl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;dihydrochloride
CID 119892146
4-hydroxy-N-[3-(propylcarbamoyl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119712065
4-hydroxy-N-(3-iodophenyl)pyrrolidine-2-carboxamide
CID 43124625
N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119680258
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119938232
3-(2,3-dihydroindole-1-carbonyl)benzoic acid
CID 43452867

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride (CID 119761222) is N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride is Cl.O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)C1CC(O)CN1.
What is the InChIKey of N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is WQYRCBXZJQLISK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3.ClH/c24-16-11-17(21-12-16)19(25)22-15-6-3-5-14(10-15)20(26)23-9-8-13-4-1-2-7-18(13)23;/h1-7,10,16-17,21,24H,8-9,11-12H2,(H,22,25);1H.
What are the key properties of N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 387.87 g/mol, XLogP of 1.97, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119761222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).