[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine

C17H15N5O — CID 118663590

IUPAC[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine
SMILESCc1cccc(-n2ncc3ccc(-c4coc(CN)n4)cc32)n1
InChIInChI=1S/C17H15N5O/c1-11-3-2-4-16(20-11)22-15-7-12(5-6-13(15)9-19-22)14-10-23-17(8-18)21-14/h2-7,9-10H,8,18H2,1H3
InChIKeyBAQKVXLYRDFRCV-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.84
Rot. Bonds3

About [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine

[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine (PubChem CID 118663590) has the molecular formula C17H15N5O and a molecular weight of 305.34 g/mol. Its IUPAC name is [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine
PubChem CID118663590
Molecular FormulaC17H15N5O
Molecular Weight305.34 g/mol
Exact Mass305.13
IUPAC Name[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine
SMILESCc1cccc(-n2ncc3ccc(-c4coc(CN)n4)cc32)n1
InChIInChI=1S/C17H15N5O/c1-11-3-2-4-16(20-11)22-15-7-12(5-6-13(15)9-19-22)14-10-23-17(8-18)21-14/h2-7,9-10H,8,18H2,1H3
InChIKeyBAQKVXLYRDFRCV-UHFFFAOYSA-N
XLogP2.84
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine (CID 118663590) is [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine is Cc1cccc(-n2ncc3ccc(-c4coc(CN)n4)cc32)n1.
What is the InChIKey of [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine?
The InChIKey is BAQKVXLYRDFRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O/c1-11-3-2-4-16(20-11)22-15-7-12(5-6-13(15)9-19-22)14-10-23-17(8-18)21-14/h2-7,9-10H,8,18H2,1H3.
What are the key properties of [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine?
[4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine has a molecular weight of 305.34 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 118663590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).