2,3-dipropyl-7H-indolizin-1-one

C14H19NO — CID 154416271

IUPAC2,3-dipropyl-7H-indolizin-1-one
SMILESCCCC1=C(CCC)N2C=CCC=C2C1=O
InChIInChI=1S/C14H19NO/c1-3-7-11-12(8-4-2)15-10-6-5-9-13(15)14(11)16/h6,9-10H,3-5,7-8H2,1-2H3
InChIKeyZVGYIXURCWLDDZ-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.53
Rot. Bonds4

About 2,3-dipropyl-7H-indolizin-1-one

2,3-dipropyl-7H-indolizin-1-one (PubChem CID 154416271) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2,3-dipropyl-7H-indolizin-1-one.

Molecular Properties

Compound Name2,3-dipropyl-7H-indolizin-1-one
PubChem CID154416271
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2,3-dipropyl-7H-indolizin-1-one
SMILESCCCC1=C(CCC)N2C=CCC=C2C1=O
InChIInChI=1S/C14H19NO/c1-3-7-11-12(8-4-2)15-10-6-5-9-13(15)14(11)16/h6,9-10H,3-5,7-8H2,1-2H3
InChIKeyZVGYIXURCWLDDZ-UHFFFAOYSA-N
XLogP3.53
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dipropyl-7H-indolizin-1-one?
The IUPAC name of 2,3-dipropyl-7H-indolizin-1-one (CID 154416271) is 2,3-dipropyl-7H-indolizin-1-one.
What is the SMILES notation for 2,3-dipropyl-7H-indolizin-1-one?
The canonical SMILES for 2,3-dipropyl-7H-indolizin-1-one is CCCC1=C(CCC)N2C=CCC=C2C1=O.
What is the InChIKey of 2,3-dipropyl-7H-indolizin-1-one?
The InChIKey is ZVGYIXURCWLDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-7-11-12(8-4-2)15-10-6-5-9-13(15)14(11)16/h6,9-10H,3-5,7-8H2,1-2H3.
What are the key properties of 2,3-dipropyl-7H-indolizin-1-one?
2,3-dipropyl-7H-indolizin-1-one has a molecular weight of 217.31 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dipropyl-7H-indolizin-1-one is sourced from PubChem (CID 154416271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).