1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone

C17H20N2O2 — CID 134795489

IUPAC1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone
SMILESCC(=O)N1CC2(Cc3ccccc31)CN(C(=O)C1CC1)C2
InChIInChI=1S/C17H20N2O2/c1-12(20)19-11-17(8-14-4-2-3-5-15(14)19)9-18(10-17)16(21)13-6-7-13/h2-5,13H,6-11H2,1H3
InChIKeyJJCHOZLIUDXADP-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.83
Rot. Bonds1

About 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone

1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone (PubChem CID 134795489) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone.

Molecular Properties

Compound Name1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone
PubChem CID134795489
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone
SMILESCC(=O)N1CC2(Cc3ccccc31)CN(C(=O)C1CC1)C2
InChIInChI=1S/C17H20N2O2/c1-12(20)19-11-17(8-14-4-2-3-5-15(14)19)9-18(10-17)16(21)13-6-7-13/h2-5,13H,6-11H2,1H3
InChIKeyJJCHOZLIUDXADP-UHFFFAOYSA-N
XLogP1.83
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 1-acetylspiro[2,4-dihydroquinoline-3,3'-azetidine]-1'-carboxylate
CID 134793217
4-(1-acetylspiro[2,4-dihydroquinoline-3,3'-pyrrolidine]-1'-yl)-4-oxobutanoic acid
CID 134790704
1-[1'-(oxetan-3-yl)spiro[2,4-dihydroquinoline-3,4'-piperidine]-1-yl]ethanone
CID 134788666
4-(1-acetylspiro[2,4-dihydroquinoline-3,3'-piperidine]-1'-yl)-4-oxobutanoic acid
CID 134788711
4-[1-(cyclopentanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-pyrrolidine]-1'-yl]-4-oxobutanoic acid
CID 134791170
cyclopropyl-[4-(2,3-dihydroindole-1-carbonyl)piperidin-1-yl]methanone
CID 26290467
cyclopentyl-[1'-(cyclopropylmethyl)spiro[2,4-dihydroquinoline-3,3'-piperidine]-1-yl]methanone
CID 134788894
[1'-(cyclohexylmethyl)spiro[2,4-dihydroquinoline-3,3'-piperidine]-1-yl]-cyclopentylmethanone
CID 134788181
1-[3-(2,3-dihydroindole-1-carbonyl)azetidin-1-yl]ethanone
CID 90511233
1-(2-chloroacetyl)spiro[2,4-dihydroquinoline-3,3'-cyclopentane]-1'-carboxamide
CID 170442478
cyclopropyl-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)methanone
CID 126759987
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
CID 24736613

Frequently Asked Questions

What is the IUPAC name of 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone?
The IUPAC name of 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone (CID 134795489) is 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone.
What is the SMILES notation for 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone?
The canonical SMILES for 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone is CC(=O)N1CC2(Cc3ccccc31)CN(C(=O)C1CC1)C2.
What is the InChIKey of 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone?
The InChIKey is JJCHOZLIUDXADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(20)19-11-17(8-14-4-2-3-5-15(14)19)9-18(10-17)16(21)13-6-7-13/h2-5,13H,6-11H2,1H3.
What are the key properties of 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone?
1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone has a molecular weight of 284.36 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1'-(cyclopropanecarbonyl)spiro[2,4-dihydroquinoline-3,3'-azetidine]-1-yl]ethanone is sourced from PubChem (CID 134795489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).