N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide

C14H15N5O2 — CID 86285787

IUPACN-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide
SMILESCC(C)c1nc(CNC(=O)c2n[nH]c3ccccc23)no1
InChIInChI=1S/C14H15N5O2/c1-8(2)14-16-11(19-21-14)7-15-13(20)12-9-5-3-4-6-10(9)17-18-12/h3-6,8H,7H2,1-2H3,(H,15,20)(H,17,18)
InChIKeyLETGEPUGCRWIDB-UHFFFAOYSA-N
MW285.31 g/mol
LogP2.00
Rot. Bonds4

About N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide

N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide (PubChem CID 86285787) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide
PubChem CID86285787
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC NameN-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide
SMILESCC(C)c1nc(CNC(=O)c2n[nH]c3ccccc23)no1
InChIInChI=1S/C14H15N5O2/c1-8(2)14-16-11(19-21-14)7-15-13(20)12-9-5-3-4-6-10(9)17-18-12/h3-6,8H,7H2,1-2H3,(H,15,20)(H,17,18)
InChIKeyLETGEPUGCRWIDB-UHFFFAOYSA-N
XLogP2.00
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylpropyl)-1H-indazole-3-carboxamide
CID 42477800
N-[[4-(2-methylpropanoylamino)phenyl]methyl]-1H-indazole-3-carboxamide
CID 51332998
2-phenyl-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1,3-oxazole-4-carboxamide
CID 50755040
N-(2-methylsulfanylpropyl)-1H-indazole-3-carboxamide
CID 113322050
N-(2,3,3-trimethylbutyl)-1H-indazole-3-carboxamide
CID 78966222
N-[(4-acetamidophenyl)methyl]-1H-indazole-3-carboxamide
CID 18154228
2-[(1H-indazole-3-carbonylamino)methyl]-3-methylbutanoic acid
CID 65220058
N-(3-ethylpentan-2-yl)-1H-indazole-3-carboxamide
CID 63851037
N-[(2R)-1-hydroxybutan-2-yl]-1H-indazole-3-carboxamide
CID 103920152
N-(4-propan-2-ylphenyl)-1H-indazole-3-carboxamide
CID 42477807
N-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]-1H-indazole-3-carboxamide
CID 170858384
N-[3-(2-methylpropylamino)-3-oxopropyl]-1H-indazole-3-carboxamide
CID 115605737

Frequently Asked Questions

What is the IUPAC name of N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide (CID 86285787) is N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide is CC(C)c1nc(CNC(=O)c2n[nH]c3ccccc23)no1.
What is the InChIKey of N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is LETGEPUGCRWIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-8(2)14-16-11(19-21-14)7-15-13(20)12-9-5-3-4-6-10(9)17-18-12/h3-6,8H,7H2,1-2H3,(H,15,20)(H,17,18).
What are the key properties of N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide?
N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 285.31 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 86285787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).