1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one

C16H20N2O — CID 134792521

IUPAC1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCN(CC1CC1)C2
InChIInChI=1S/C16H20N2O/c19-15-16(7-8-18(11-16)10-12-5-6-12)9-13-3-1-2-4-14(13)17-15/h1-4,12H,5-11H2,(H,17,19)
InChIKeyWHNRCKONUJLIRY-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.28
Rot. Bonds2

About 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one

1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one (PubChem CID 134792521) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
PubChem CID134792521
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCN(CC1CC1)C2
InChIInChI=1S/C16H20N2O/c19-15-16(7-8-18(11-16)10-12-5-6-12)9-13-3-1-2-4-14(13)17-15/h1-4,12H,5-11H2,(H,17,19)
InChIKeyWHNRCKONUJLIRY-UHFFFAOYSA-N
XLogP2.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one (CID 134792521) is 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one is O=C1Nc2ccccc2CC12CCN(CC1CC1)C2.
What is the InChIKey of 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The InChIKey is WHNRCKONUJLIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c19-15-16(7-8-18(11-16)10-12-5-6-12)9-13-3-1-2-4-14(13)17-15/h1-4,12H,5-11H2,(H,17,19).
What are the key properties of 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one has a molecular weight of 256.35 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(cyclopropylmethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 134792521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).