[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone

C17H19N5O2 — CID 53146719

IUPAC[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone
SMILESCc1c(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)noc1N
InChIInChI=1S/C17H19N5O2/c1-10-14(21-24-16(10)18)11-6-8-22(9-7-11)17(23)15-12-4-2-3-5-13(12)19-20-15/h2-5,11H,6-9,18H2,1H3,(H,19,20)
InChIKeyYJSZQVZNHJUGTL-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.46
Rot. Bonds2

About [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone

[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone (PubChem CID 53146719) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone.

Molecular Properties

Compound Name[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone
PubChem CID53146719
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC Name[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone
SMILESCc1c(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)noc1N
InChIInChI=1S/C17H19N5O2/c1-10-14(21-24-16(10)18)11-6-8-22(9-7-11)17(23)15-12-4-2-3-5-13(12)19-20-15/h2-5,11H,6-9,18H2,1H3,(H,19,20)
InChIKeyYJSZQVZNHJUGTL-UHFFFAOYSA-N
XLogP2.46
TPSA101.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone?
The IUPAC name of [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone (CID 53146719) is [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone.
What is the SMILES notation for [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone?
The canonical SMILES for [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone is Cc1c(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)noc1N.
What is the InChIKey of [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone?
The InChIKey is YJSZQVZNHJUGTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-10-14(21-24-16(10)18)11-6-8-22(9-7-11)17(23)15-12-4-2-3-5-13(12)19-20-15/h2-5,11H,6-9,18H2,1H3,(H,19,20).
What are the key properties of [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone?
[4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone has a molecular weight of 325.37 g/mol, XLogP of 2.46, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-amino-4-methyl-1,2-oxazol-3-yl)piperidin-1-yl]-(1H-indazol-3-yl)methanone is sourced from PubChem (CID 53146719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).