N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide

C20H23N3O2 — CID 119866796

IUPACN-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(CN2CCc3ccccc32)cc1)C1CC(O)CN1
InChIInChI=1S/C20H23N3O2/c24-17-11-18(21-12-17)20(25)22-16-7-5-14(6-8-16)13-23-10-9-15-3-1-2-4-19(15)23/h1-8,17-18,21,24H,9-13H2,(H,22,25)
InChIKeyBMUHRVMCARXWLA-UHFFFAOYSA-N
MW337.42 g/mol
LogP1.91
Rot. Bonds4

About N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide

N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 119866796) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide
PubChem CID119866796
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(CN2CCc3ccccc32)cc1)C1CC(O)CN1
InChIInChI=1S/C20H23N3O2/c24-17-11-18(21-12-17)20(25)22-16-7-5-14(6-8-16)13-23-10-9-15-3-1-2-4-19(15)23/h1-8,17-18,21,24H,9-13H2,(H,22,25)
InChIKeyBMUHRVMCARXWLA-UHFFFAOYSA-N
XLogP1.91
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119866803
N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119866777
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119761222
N-(4-acetamidophenyl)-4-(2,3-dihydroindol-1-ylmethyl)benzamide
CID 46771578
N-[2-(2,3-dihydroindol-1-yl)propyl]-4-hydroxypyrrolidine-2-carboxamide;dihydrochloride
CID 119856800
4-(2,3-dihydroindol-1-ylmethyl)-N-(4-ethylphenyl)benzamide
CID 99953473
N-[4-(carbamoylamino)phenyl]-4-hydroxypyrrolidine-2-carboxamide
CID 43711133
4-amino-N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]pentanamide
CID 120565087
N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119680258
4-hydroxy-N-[4-(propan-2-yloxymethyl)phenyl]pyrrolidine-2-carboxamide
CID 119742872
4-hydroxy-N-[4-(2-phenylethylcarbamoyl)phenyl]pyrrolidine-2-carboxamide
CID 119749178
2-amino-N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]pentanamide;dihydrochloride
CID 119866785

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide (CID 119866796) is N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide is O=C(Nc1ccc(CN2CCc3ccccc32)cc1)C1CC(O)CN1.
What is the InChIKey of N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is BMUHRVMCARXWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c24-17-11-18(21-12-17)20(25)22-16-7-5-14(6-8-16)13-23-10-9-15-3-1-2-4-19(15)23/h1-8,17-18,21,24H,9-13H2,(H,22,25).
What are the key properties of N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide?
N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 1.91, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 119866796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).