N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine

C14H12N4O — CID 162669351

IUPACN-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine
SMILESCc1cccnc1Nc1ncc(-c2ccccn2)o1
InChIInChI=1S/C14H12N4O/c1-10-5-4-8-16-13(10)18-14-17-9-12(19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18)
InChIKeyJSXSYBTZZZCIKK-UHFFFAOYSA-N
MW252.28 g/mol
LogP3.18
Rot. Bonds3

About N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine

N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine (PubChem CID 162669351) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine
PubChem CID162669351
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC NameN-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine
SMILESCc1cccnc1Nc1ncc(-c2ccccn2)o1
InChIInChI=1S/C14H12N4O/c1-10-5-4-8-16-13(10)18-14-17-9-12(19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18)
InChIKeyJSXSYBTZZZCIKK-UHFFFAOYSA-N
XLogP3.18
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine?
The IUPAC name of N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine (CID 162669351) is N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine is Cc1cccnc1Nc1ncc(-c2ccccn2)o1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine?
The InChIKey is JSXSYBTZZZCIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-10-5-4-8-16-13(10)18-14-17-9-12(19-14)11-6-2-3-7-15-11/h2-9H,1H3,(H,16,17,18).
What are the key properties of N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine?
N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine has a molecular weight of 252.28 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-5-pyridin-2-yl-1,3-oxazol-2-amine is sourced from PubChem (CID 162669351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).