1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one

C23H24N2O2 — CID 142706537

IUPAC1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one
SMILESO=C1CC2(CCN(CCc3c[nH]c4ccccc34)CC2)Oc2ccccc21
InChIInChI=1S/C23H24N2O2/c26-21-15-23(27-22-8-4-2-6-19(21)22)10-13-25(14-11-23)12-9-17-16-24-20-7-3-1-5-18(17)20/h1-8,16,24H,9-15H2
InChIKeyBDDVSBLWDLHAKG-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.21
Rot. Bonds3

About 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one

1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one (PubChem CID 142706537) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one.

Molecular Properties

Compound Name1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one
PubChem CID142706537
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one
SMILESO=C1CC2(CCN(CCc3c[nH]c4ccccc34)CC2)Oc2ccccc21
InChIInChI=1S/C23H24N2O2/c26-21-15-23(27-22-8-4-2-6-19(21)22)10-13-25(14-11-23)12-9-17-16-24-20-7-3-1-5-18(17)20/h1-8,16,24H,9-15H2
InChIKeyBDDVSBLWDLHAKG-UHFFFAOYSA-N
XLogP4.21
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hydroxy-3-[1'-[2-(1H-indol-3-yl)ethyl]-4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl]prop-2-enamide
CID 123922862
3-[2-(4,4-difluoropiperidin-1-yl)ethyl]-1H-indole
CID 117007752
4-ethyl-9-[2-(1H-indol-3-yl)ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one;hydrochloride
CID 20537388
3-(2-pyrrolidin-1-ylethyl)-1H-indole
CID 26393
8-[2-(1H-indol-3-yl)ethyl]-4-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 13016630
tert-butyl N-[1-[[3-(1H-indol-3-yl)-1-oxo-1-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamate
CID 19030466
4-[2-(1H-indol-3-yl)ethyl]piperazine-1-carbaldehyde
CID 91084591
4-[2-(1H-indol-3-yl)ethyl]-1,4-thiazinane 1,1-dioxide
CID 2767993
2-amino-N-[3-(1H-indol-3-yl)-1-(6-methyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)-1-oxopropan-2-yl]-2-methylpropanamide;hydrochloride
CID 19030490
1'-benzylspiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 130157727
2-(4-oxospiro[3H-chromene-2,4'-azepane]-1'-yl)acetic acid
CID 164694844
1'-[3-(3-acetyl-7-ethylindol-1-yl)propyl]spiro[3H-chromene-2,4'-piperidine]-4-one
CID 58968020

Frequently Asked Questions

What is the IUPAC name of 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one?
The IUPAC name of 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one (CID 142706537) is 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one.
What is the SMILES notation for 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one?
The canonical SMILES for 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one is O=C1CC2(CCN(CCc3c[nH]c4ccccc34)CC2)Oc2ccccc21.
What is the InChIKey of 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one?
The InChIKey is BDDVSBLWDLHAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c26-21-15-23(27-22-8-4-2-6-19(21)22)10-13-25(14-11-23)12-9-17-16-24-20-7-3-1-5-18(17)20/h1-8,16,24H,9-15H2.
What are the key properties of 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one?
1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one has a molecular weight of 360.46 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[2-(1H-indol-3-yl)ethyl]spiro[3H-chromene-2,4'-piperidine]-4-one is sourced from PubChem (CID 142706537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).