(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone

C20H21FN2O2 — CID 23764734

IUPAC(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CC2(CCN(C3CC3)CC2)c2cc(F)ccc21
InChIInChI=1S/C20H21FN2O2/c21-14-3-6-17-16(12-14)20(7-9-22(10-8-20)15-4-5-15)13-23(17)19(24)18-2-1-11-25-18/h1-3,6,11-12,15H,4-5,7-10,13H2
InChIKeyVQMSOXKNNIFZAR-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.58
Rot. Bonds2

About (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone

(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone (PubChem CID 23764734) has the molecular formula C20H21FN2O2 and a molecular weight of 340.40 g/mol. Its IUPAC name is (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone
PubChem CID23764734
Molecular FormulaC20H21FN2O2
Molecular Weight340.40 g/mol
Exact Mass340.16
IUPAC Name(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CC2(CCN(C3CC3)CC2)c2cc(F)ccc21
InChIInChI=1S/C20H21FN2O2/c21-14-3-6-17-16(12-14)20(7-9-22(10-8-20)15-4-5-15)13-23(17)19(24)18-2-1-11-25-18/h1-3,6,11-12,15H,4-5,7-10,13H2
InChIKeyVQMSOXKNNIFZAR-UHFFFAOYSA-N
XLogP3.58
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

furan-2-yl-[5-methyl-1'-(3-methylidenecyclohexyl)spiro[2H-indole-3,4'-piperidine]-1-yl]methanone
CID 89379555
1'-cyclopropyl-5-fluoro-N-propylspiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 23994922
1-[5-fluoro-1'-[4-(piperidine-1-carbonyl)cyclohexyl]spiro[2H-indole-3,4'-piperidine]-1-yl]ethanone
CID 59433818
1'-cyclopropyl-5-fluoro-N-(4-methoxyphenyl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 23959515
5-fluoro-1'-[1-(3-fluorobenzoyl)piperidin-4-yl]-N,N-dimethylspiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 59433414
1'-cyclopropyl-N-(3-fluorophenyl)-5-methylspiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 23877217
ethyl 4-[1-(2,5-dimethylfuran-3-carbonyl)-5-fluorospiro[2H-indole-3,4'-piperidine]-1'-yl]piperidine-1-carboxylate
CID 59433428
tert-butyl 5-fluoro-1'-(8-phenylmethoxycarbonyl-8-azabicyclo[3.2.1]octan-3-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxylate
CID 59433302
[1'-(cyclopropylmethyl)-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl]-(3-fluorophenyl)methanone
CID 59003926
ethyl 4-[5-fluoro-1-(4-methoxybenzoyl)spiro[2H-indole-3,4'-piperidine]-1'-yl]piperidine-1-carboxylate
CID 11518875
5-fluoro-N,N-dimethyl-1'-[1-(pyridine-2-carbonyl)piperidin-4-yl]spiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 59433574
5-fluorospiro[2H-indole-3,4'-piperidine]-1,1'-dicarboxylic acid
CID 149159822

Frequently Asked Questions

What is the IUPAC name of (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone?
The IUPAC name of (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone (CID 23764734) is (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone?
The canonical SMILES for (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone is O=C(c1ccco1)N1CC2(CCN(C3CC3)CC2)c2cc(F)ccc21.
What is the InChIKey of (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone?
The InChIKey is VQMSOXKNNIFZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O2/c21-14-3-6-17-16(12-14)20(7-9-22(10-8-20)15-4-5-15)13-23(17)19(24)18-2-1-11-25-18/h1-3,6,11-12,15H,4-5,7-10,13H2.
What are the key properties of (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone?
(1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone has a molecular weight of 340.40 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1'-cyclopropyl-5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 23764734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).