4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine

C13H19NO — CID 177282872

IUPAC4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine
SMILESCC(C)C1=NC(C(C)C)Cc2occc21
InChIInChI=1S/C13H19NO/c1-8(2)11-7-12-10(5-6-15-12)13(14-11)9(3)4/h5-6,8-9,11H,7H2,1-4H3
InChIKeyIOJGNRDTJOPKFO-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.31
Rot. Bonds2

About 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine

4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine (PubChem CID 177282872) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine.

Molecular Properties

Compound Name4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine
PubChem CID177282872
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine
SMILESCC(C)C1=NC(C(C)C)Cc2occc21
InChIInChI=1S/C13H19NO/c1-8(2)11-7-12-10(5-6-15-12)13(14-11)9(3)4/h5-6,8-9,11H,7H2,1-4H3
InChIKeyIOJGNRDTJOPKFO-UHFFFAOYSA-N
XLogP3.31
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 123940471
(4S)-4-propan-2-yl-2-[2-[2-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]sulfanylphenyl]-4,5-dihydro-1,3-oxazole
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Frequently Asked Questions

What is the IUPAC name of 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine?
The IUPAC name of 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine (CID 177282872) is 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine.
What is the SMILES notation for 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine?
The canonical SMILES for 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine is CC(C)C1=NC(C(C)C)Cc2occc21.
What is the InChIKey of 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine?
The InChIKey is IOJGNRDTJOPKFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-8(2)11-7-12-10(5-6-15-12)13(14-11)9(3)4/h5-6,8-9,11H,7H2,1-4H3.
What are the key properties of 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine?
4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine has a molecular weight of 205.30 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-di(propan-2-yl)-6,7-dihydrofuro[3,2-c]pyridine is sourced from PubChem (CID 177282872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).