(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide

C16H19N3O3 — CID 164635420

IUPAC(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1nn(C)cc1CNC(=O)[C@@H]1CCc2cccc(O)c21
InChIInChI=1S/C16H19N3O3/c1-19-9-11(16(18-19)22-2)8-17-15(21)12-7-6-10-4-3-5-13(20)14(10)12/h3-5,9,12,20H,6-8H2,1-2H3,(H,17,21)/t12-/m1/s1
InChIKeyUZLOKAOFVZOEMN-GFCCVEGCSA-N
MW301.35 g/mol
LogP1.48
Rot. Bonds4

About (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide

(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 164635420) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound Name(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID164635420
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1nn(C)cc1CNC(=O)[C@@H]1CCc2cccc(O)c21
InChIInChI=1S/C16H19N3O3/c1-19-9-11(16(18-19)22-2)8-17-15(21)12-7-6-10-4-3-5-13(20)14(10)12/h3-5,9,12,20H,6-8H2,1-2H3,(H,17,21)/t12-/m1/s1
InChIKeyUZLOKAOFVZOEMN-GFCCVEGCSA-N
XLogP1.48
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-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 (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide (CID 164635420) is (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide is COc1nn(C)cc1CNC(=O)[C@@H]1CCc2cccc(O)c21.
What is the InChIKey of (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is UZLOKAOFVZOEMN-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-19-9-11(16(18-19)22-2)8-17-15(21)12-7-6-10-4-3-5-13(20)14(10)12/h3-5,9,12,20H,6-8H2,1-2H3,(H,17,21)/t12-/m1/s1.
What are the key properties of (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide?
(1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 164635420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).