N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide

C20H19N3O2 — CID 10892960

IUPACN-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESCOc1ccc(-c2cc(NC(=O)C3Cc4ccccc4C3)n[nH]2)cc1
InChIInChI=1S/C20H19N3O2/c1-25-17-8-6-13(7-9-17)18-12-19(23-22-18)21-20(24)16-10-14-4-2-3-5-15(14)11-16/h2-9,12,16H,10-11H2,1H3,(H2,21,22,23,24)
InChIKeyFFJSTXUOCCZDHD-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.44
Rot. Bonds4

About N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide

N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 10892960) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID10892960
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESCOc1ccc(-c2cc(NC(=O)C3Cc4ccccc4C3)n[nH]2)cc1
InChIInChI=1S/C20H19N3O2/c1-25-17-8-6-13(7-9-17)18-12-19(23-22-18)21-20(24)16-10-14-4-2-3-5-15(14)11-16/h2-9,12,16H,10-11H2,1H3,(H2,21,22,23,24)
InChIKeyFFJSTXUOCCZDHD-UHFFFAOYSA-N
XLogP3.44
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide (CID 10892960) is N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide is COc1ccc(-c2cc(NC(=O)C3Cc4ccccc4C3)n[nH]2)cc1.
What is the InChIKey of N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is FFJSTXUOCCZDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-25-17-8-6-13(7-9-17)18-12-19(23-22-18)21-20(24)16-10-14-4-2-3-5-15(14)11-16/h2-9,12,16H,10-11H2,1H3,(H2,21,22,23,24).
What are the key properties of N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 10892960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).