2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide

C24H26N4O — CID 54027872

IUPAC2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide
SMILESCC(C)(C)c1cc2n(n1)-c1ccccc1CN2C(=O)NC1CCc2ccccc21
InChIInChI=1S/C24H26N4O/c1-24(2,3)21-14-22-27(15-17-9-5-7-11-20(17)28(22)26-21)23(29)25-19-13-12-16-8-4-6-10-18(16)19/h4-11,14,19H,12-13,15H2,1-3H3,(H,25,29)
InChIKeyLDMUUGATJHICOK-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.89
Rot. Bonds1

About 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide

2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide (PubChem CID 54027872) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide.

Molecular Properties

Compound Name2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide
PubChem CID54027872
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide
SMILESCC(C)(C)c1cc2n(n1)-c1ccccc1CN2C(=O)NC1CCc2ccccc21
InChIInChI=1S/C24H26N4O/c1-24(2,3)21-14-22-27(15-17-9-5-7-11-20(17)28(22)26-21)23(29)25-19-13-12-16-8-4-6-10-18(16)19/h4-11,14,19H,12-13,15H2,1-3H3,(H,25,29)
InChIKeyLDMUUGATJHICOK-UHFFFAOYSA-N
XLogP4.89
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide with MolForge

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Related Compounds

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N-(2,3-dihydro-1H-inden-1-yl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide
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ethyl 2-[3-[3-tert-butyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoylamino)pyrazol-1-yl]phenyl]acetate
CID 77257582
2-[(1R)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide?
The IUPAC name of 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide (CID 54027872) is 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide.
What is the SMILES notation for 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide?
The canonical SMILES for 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide is CC(C)(C)c1cc2n(n1)-c1ccccc1CN2C(=O)NC1CCc2ccccc21.
What is the InChIKey of 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide?
The InChIKey is LDMUUGATJHICOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-24(2,3)21-14-22-27(15-17-9-5-7-11-20(17)28(22)26-21)23(29)25-19-13-12-16-8-4-6-10-18(16)19/h4-11,14,19H,12-13,15H2,1-3H3,(H,25,29).
What are the key properties of 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide?
2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 4.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-(2,3-dihydro-1H-inden-1-yl)-5H-pyrazolo[1,5-a]quinazoline-4-carboxamide is sourced from PubChem (CID 54027872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).