(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone

C15H15N3O — CID 19591093

IUPAC(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(C2CC2)[nH]n1)N1CCc2ccccc21
InChIInChI=1S/C15H15N3O/c19-15(13-9-12(16-17-13)10-5-6-10)18-8-7-11-3-1-2-4-14(11)18/h1-4,9-10H,5-8H2,(H,16,17)
InChIKeySGCPUPVOPFEJKK-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.49
Rot. Bonds2

About (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone

(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 19591093) has the molecular formula C15H15N3O and a molecular weight of 253.30 g/mol. Its IUPAC name is (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID19591093
Molecular FormulaC15H15N3O
Molecular Weight253.30 g/mol
Exact Mass253.12
IUPAC Name(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(C2CC2)[nH]n1)N1CCc2ccccc21
InChIInChI=1S/C15H15N3O/c19-15(13-9-12(16-17-13)10-5-6-10)18-8-7-11-3-1-2-4-14(11)18/h1-4,9-10H,5-8H2,(H,16,17)
InChIKeySGCPUPVOPFEJKK-UHFFFAOYSA-N
XLogP2.49
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone (CID 19591093) is (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone is O=C(c1cc(C2CC2)[nH]n1)N1CCc2ccccc21.
What is the InChIKey of (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is SGCPUPVOPFEJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c19-15(13-9-12(16-17-13)10-5-6-10)18-8-7-11-3-1-2-4-14(11)18/h1-4,9-10H,5-8H2,(H,16,17).
What are the key properties of (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone?
(5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 253.30 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-1H-pyrazol-3-yl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 19591093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).