4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine

C12H16N4O — CID 66912234

IUPAC4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine
SMILESCc1nccc2nc(NC3CCNCC3)oc12
InChIInChI=1S/C12H16N4O/c1-8-11-10(4-7-14-8)16-12(17-11)15-9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,15,16)
InChIKeyZGPIWCNMKATMIP-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.70
Rot. Bonds2

About 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine

4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine (PubChem CID 66912234) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound Name4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine
PubChem CID66912234
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine
SMILESCc1nccc2nc(NC3CCNCC3)oc12
InChIInChI=1S/C12H16N4O/c1-8-11-10(4-7-14-8)16-12(17-11)15-9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,15,16)
InChIKeyZGPIWCNMKATMIP-UHFFFAOYSA-N
XLogP1.70
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine?
The IUPAC name of 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine (CID 66912234) is 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine is Cc1nccc2nc(NC3CCNCC3)oc12.
What is the InChIKey of 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine?
The InChIKey is ZGPIWCNMKATMIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-8-11-10(4-7-14-8)16-12(17-11)15-9-2-5-13-6-3-9/h4,7,9,13H,2-3,5-6H2,1H3,(H,15,16).
What are the key properties of 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine?
4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine has a molecular weight of 232.29 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-piperidin-4-yl-[1,3]oxazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 66912234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).