5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine

C14H16N4O — CID 25165277

IUPAC5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine
SMILESCC(C)Cc1cc(-c2ccc3[nH]nc(N)c3c2)on1
InChIInChI=1S/C14H16N4O/c1-8(2)5-10-7-13(19-18-10)9-3-4-12-11(6-9)14(15)17-16-12/h3-4,6-8H,5H2,1-2H3,(H3,15,16,17)
InChIKeyFQEODTMNWMDUMD-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.00
Rot. Bonds3

About 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine

5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine (PubChem CID 25165277) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine.

Molecular Properties

Compound Name5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine
PubChem CID25165277
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine
SMILESCC(C)Cc1cc(-c2ccc3[nH]nc(N)c3c2)on1
InChIInChI=1S/C14H16N4O/c1-8(2)5-10-7-13(19-18-10)9-3-4-12-11(6-9)14(15)17-16-12/h3-4,6-8H,5H2,1-2H3,(H3,15,16,17)
InChIKeyFQEODTMNWMDUMD-UHFFFAOYSA-N
XLogP3.00
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-5-(1H-pyrazol-5-yl)-2,1-benzoxazole
CID 1474300
3-benzyl-5-(1H-indazol-5-yl)isoxazole
CID 25164675
5-(1H-indazol-5-yl)-3-propylisoxazole
CID 25164677
5-(3-Benzylisoxazol-5-yl)-1h-indazol-3-amine
CID 25165278
N-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 137658261
(5P)-3-(3,5-dimethylphenyl)-5-(1H-tetrazol-5-yl)-2,1-benzoxazole
CID 169143898
(5P)-3-phenyl-5-(1H-tetrazol-5-yl)-2,1-benzoxazole
CID 170101021
6-(3-cyclopropyl-5-methyl-1H-pyrazol-4-yl)-1,2-benzoxazol-3-amine
CID 137637031
5-(3,5-dimethylisoxazol-4-yl)-1H-indazol-3-amine
CID 44570388
3-(4-fluorophenyl)-5-(2H-tetrazol-5-yl)-2,1-benzoxazole
CID 169143775
3-[4-[5-(2H-tetrazol-5-yl)-2,1-benzoxazol-3-yl]phenyl]aniline
CID 170102643
3-[3-[5-(2H-tetrazol-5-yl)-2,1-benzoxazol-3-yl]phenyl]aniline
CID 176733207

Frequently Asked Questions

What is the IUPAC name of 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine?
The IUPAC name of 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine (CID 25165277) is 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine.
What is the SMILES notation for 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine?
The canonical SMILES for 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine is CC(C)Cc1cc(-c2ccc3[nH]nc(N)c3c2)on1.
What is the InChIKey of 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine?
The InChIKey is FQEODTMNWMDUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-8(2)5-10-7-13(19-18-10)9-3-4-12-11(6-9)14(15)17-16-12/h3-4,6-8H,5H2,1-2H3,(H3,15,16,17).
What are the key properties of 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine?
5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine has a molecular weight of 256.31 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(2-methylpropyl)-1,2-oxazol-5-yl]-1H-indazol-3-amine is sourced from PubChem (CID 25165277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).