4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine

C13H18N4O — CID 66249134

IUPAC4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine
SMILESCCn1c(C2(C)COCC2N)nc2cnccc21
InChIInChI=1S/C13H18N4O/c1-3-17-10-4-5-15-6-9(10)16-12(17)13(2)8-18-7-11(13)14/h4-6,11H,3,7-8,14H2,1-2H3
InChIKeyMOMVRSJVJVDWIO-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.07
Rot. Bonds2

About 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine

4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine (PubChem CID 66249134) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine.

Molecular Properties

Compound Name4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine
PubChem CID66249134
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine
SMILESCCn1c(C2(C)COCC2N)nc2cnccc21
InChIInChI=1S/C13H18N4O/c1-3-17-10-4-5-15-6-9(10)16-12(17)13(2)8-18-7-11(13)14/h4-6,11H,3,7-8,14H2,1-2H3
InChIKeyMOMVRSJVJVDWIO-UHFFFAOYSA-N
XLogP1.07
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine?
The IUPAC name of 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine (CID 66249134) is 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine.
What is the SMILES notation for 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine?
The canonical SMILES for 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine is CCn1c(C2(C)COCC2N)nc2cnccc21.
What is the InChIKey of 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine?
The InChIKey is MOMVRSJVJVDWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-3-17-10-4-5-15-6-9(10)16-12(17)13(2)8-18-7-11(13)14/h4-6,11H,3,7-8,14H2,1-2H3.
What are the key properties of 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine?
4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine has a molecular weight of 246.31 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethylimidazo[4,5-c]pyridin-2-yl)-4-methyloxolan-3-amine is sourced from PubChem (CID 66249134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).