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

C19H16ClN3O — CID 11078256

IUPACN-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(Nc1cc(-c2cccc(Cl)c2)[nH]n1)C1Cc2ccccc2C1
InChIInChI=1S/C19H16ClN3O/c20-16-7-3-6-14(10-16)17-11-18(23-22-17)21-19(24)15-8-12-4-1-2-5-13(12)9-15/h1-7,10-11,15H,8-9H2,(H2,21,22,23,24)
InChIKeyIKFYKBXVUWCIGV-UHFFFAOYSA-N
MW337.81 g/mol
LogP4.08
Rot. Bonds3

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

N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 11078256) has the molecular formula C19H16ClN3O and a molecular weight of 337.81 g/mol. Its IUPAC name is N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID11078256
Molecular FormulaC19H16ClN3O
Molecular Weight337.81 g/mol
Exact Mass337.10
IUPAC NameN-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(Nc1cc(-c2cccc(Cl)c2)[nH]n1)C1Cc2ccccc2C1
InChIInChI=1S/C19H16ClN3O/c20-16-7-3-6-14(10-16)17-11-18(23-22-17)21-19(24)15-8-12-4-1-2-5-13(12)9-15/h1-7,10-11,15H,8-9H2,(H2,21,22,23,24)
InChIKeyIKFYKBXVUWCIGV-UHFFFAOYSA-N
XLogP4.08
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 339736
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N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(4-phenylphenyl)acetamide
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N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide
CID 5330944
N-(3-(4-chlorophenyl)-1H-pyrazol-5-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 2821670
N-[5-(4-Chloro-phenyl)-2H-pyrazol-3-yl]-2-naphthalen-1-yl-acetamide
CID 10872140
N-[5-(4-Chloro-phenyl)-1H-pyrazol-3-yl]-2-naphthalen-2-yl-acetamide
CID 11002935
N-[5-(4-Chloro-phenyl)-2H-pyrazol-3-yl]-2-phenyl-acetamide
CID 11056043
Indan-2-carboxylic acid [5-(2-chloro-phenyl)-1H-pyrazol-3-yl]-amide
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2-(4-chlorophenyl)-4-(5-methyl-1H-pyrazol-3-ylamino)phthalazin-1(2H)-one
CID 11617275
3-(2-Indanyl)carbonylamino-5-(4-methylphenyl)-pyrazole
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N-(5-cyclobutyl-1H-pyrazol-3-yl)-2-(4-phenylphenyl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide (CID 11078256) is N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide is O=C(Nc1cc(-c2cccc(Cl)c2)[nH]n1)C1Cc2ccccc2C1.
What is the InChIKey of N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is IKFYKBXVUWCIGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O/c20-16-7-3-6-14(10-16)17-11-18(23-22-17)21-19(24)15-8-12-4-1-2-5-13(12)9-15/h1-7,10-11,15H,8-9H2,(H2,21,22,23,24).
What are the key properties of N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 337.81 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-chlorophenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 11078256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).