2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide

C19H23N3O3 — CID 164641249

IUPAC2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide
SMILESCn1cc([C@]2(CNC(=O)C3(O)Cc4ccccc4C3)CCCO2)cn1
InChIInChI=1S/C19H23N3O3/c1-22-12-16(11-21-22)19(7-4-8-25-19)13-20-17(23)18(24)9-14-5-2-3-6-15(14)10-18/h2-3,5-6,11-12,24H,4,7-10,13H2,1H3,(H,20,23)/t19-/m1/s1
InChIKeyHTTNDEIBSZCEHA-LJQANCHMSA-N
MW341.41 g/mol
LogP1.07
Rot. Bonds4

About 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide

2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide (PubChem CID 164641249) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide
PubChem CID164641249
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide
SMILESCn1cc([C@]2(CNC(=O)C3(O)Cc4ccccc4C3)CCCO2)cn1
InChIInChI=1S/C19H23N3O3/c1-22-12-16(11-21-22)19(7-4-8-25-19)13-20-17(23)18(24)9-14-5-2-3-6-15(14)10-18/h2-3,5-6,11-12,24H,4,7-10,13H2,1H3,(H,20,23)/t19-/m1/s1
InChIKeyHTTNDEIBSZCEHA-LJQANCHMSA-N
XLogP1.07
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide?
The IUPAC name of 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide (CID 164641249) is 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide?
The canonical SMILES for 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide is Cn1cc([C@]2(CNC(=O)C3(O)Cc4ccccc4C3)CCCO2)cn1.
What is the InChIKey of 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide?
The InChIKey is HTTNDEIBSZCEHA-LJQANCHMSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-22-12-16(11-21-22)19(7-4-8-25-19)13-20-17(23)18(24)9-14-5-2-3-6-15(14)10-18/h2-3,5-6,11-12,24H,4,7-10,13H2,1H3,(H,20,23)/t19-/m1/s1.
What are the key properties of 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide?
2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[[(2S)-2-(1-methylpyrazol-4-yl)oxolan-2-yl]methyl]-1,3-dihydroindene-2-carboxamide is sourced from PubChem (CID 164641249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).