N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

C15H18N4O2 — CID 126784633

IUPACN-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
SMILESCc1noc(C2CC2)c1NC(=O)c1n[nH]c2c1CCCC2
InChIInChI=1S/C15H18N4O2/c1-8-12(14(21-19-8)9-6-7-9)16-15(20)13-10-4-2-3-5-11(10)17-18-13/h9H,2-7H2,1H3,(H,16,20)(H,17,18)
InChIKeyBMCJDYHWGPDFEY-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.71
Rot. Bonds3

About N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide (PubChem CID 126784633) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
PubChem CID126784633
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC NameN-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
SMILESCc1noc(C2CC2)c1NC(=O)c1n[nH]c2c1CCCC2
InChIInChI=1S/C15H18N4O2/c1-8-12(14(21-19-8)9-6-7-9)16-15(20)13-10-4-2-3-5-11(10)17-18-13/h9H,2-7H2,1H3,(H,16,20)(H,17,18)
InChIKeyBMCJDYHWGPDFEY-UHFFFAOYSA-N
XLogP2.71
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide?
The IUPAC name of N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide (CID 126784633) is N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide?
The canonical SMILES for N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide is Cc1noc(C2CC2)c1NC(=O)c1n[nH]c2c1CCCC2.
What is the InChIKey of N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide?
The InChIKey is BMCJDYHWGPDFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-8-12(14(21-19-8)9-6-7-9)16-15(20)13-10-4-2-3-5-11(10)17-18-13/h9H,2-7H2,1H3,(H,16,20)(H,17,18).
What are the key properties of N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide?
N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide is sourced from PubChem (CID 126784633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).