4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine

C12H16N4O — CID 66248937

IUPAC4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine
SMILESCn1c(C2(C)COCC2N)nc2cnccc21
InChIInChI=1S/C12H16N4O/c1-12(7-17-6-10(12)13)11-15-8-5-14-4-3-9(8)16(11)2/h3-5,10H,6-7,13H2,1-2H3
InChIKeyHVYOKOGSKBAVDW-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.58
Rot. Bonds1

About 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine

4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine (PubChem CID 66248937) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine.

Molecular Properties

Compound Name4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine
PubChem CID66248937
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine
SMILESCn1c(C2(C)COCC2N)nc2cnccc21
InChIInChI=1S/C12H16N4O/c1-12(7-17-6-10(12)13)11-15-8-5-14-4-3-9(8)16(11)2/h3-5,10H,6-7,13H2,1-2H3
InChIKeyHVYOKOGSKBAVDW-UHFFFAOYSA-N
XLogP0.58
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine?
The IUPAC name of 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine (CID 66248937) is 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine.
What is the SMILES notation for 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine?
The canonical SMILES for 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine is Cn1c(C2(C)COCC2N)nc2cnccc21.
What is the InChIKey of 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine?
The InChIKey is HVYOKOGSKBAVDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-12(7-17-6-10(12)13)11-15-8-5-14-4-3-9(8)16(11)2/h3-5,10H,6-7,13H2,1-2H3.
What are the key properties of 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine?
4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine has a molecular weight of 232.29 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(1-methylimidazo[4,5-c]pyridin-2-yl)oxolan-3-amine is sourced from PubChem (CID 66248937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).