6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]

C14H19NO — CID 82277020

IUPAC6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]
SMILESCOc1ccc2c(c1)CCC21CCNCC1
InChIInChI=1S/C14H19NO/c1-16-12-2-3-13-11(10-12)4-5-14(13)6-8-15-9-7-14/h2-3,10,15H,4-9H2,1H3
InChIKeyYXHZCURNGCIRST-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.26
Rot. Bonds1

About 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]

6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine] (PubChem CID 82277020) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine].

Molecular Properties

Compound Name6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]
PubChem CID82277020
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]
SMILESCOc1ccc2c(c1)CCC21CCNCC1
InChIInChI=1S/C14H19NO/c1-16-12-2-3-13-11(10-12)4-5-14(13)6-8-15-9-7-14/h2-3,10,15H,4-9H2,1H3
InChIKeyYXHZCURNGCIRST-UHFFFAOYSA-N
XLogP2.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-7-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 92849621
6-methoxy-3,3-dimethyl-1,2-dihydroindene
CID 22152285
3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene
CID 84718386
5-iodo-8-methoxy-5-methyl-1,2,3,4-tetrahydro-3-benzazepine
CID 67206648
ethane;7-methoxy-1,2,3,4-tetrahydroisoquinoline
CID 143868283
4-(2,5-dimethoxyphenyl)-4-methylpiperidine
CID 63156571
6-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine];hydrochloride
CID 121207060
1,1-dideuterio-6-methoxy-3,4-dihydro-2H-isoquinoline
CID 134564811
8-methoxy-5,5-dimethyl-2,3-dihydro-1H-3-benzazepin-4-one
CID 168876558
6-methoxyspiro[2,4-dihydro-1H-naphthalene-3,3'-azetidine]
CID 84620045
4-(2,4-dimethoxyphenyl)piperidine-4-carbonitrile
CID 82295249
(3S)-5-methoxyspiro[1,2-dihydroindene-3,2'-azetidine]
CID 124511846

Frequently Asked Questions

What is the IUPAC name of 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]?
The IUPAC name of 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine] (CID 82277020) is 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine].
What is the SMILES notation for 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]?
The canonical SMILES for 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine] is COc1ccc2c(c1)CCC21CCNCC1.
What is the InChIKey of 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]?
The InChIKey is YXHZCURNGCIRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-12-2-3-13-11(10-12)4-5-14(13)6-8-15-9-7-14/h2-3,10,15H,4-9H2,1H3.
What are the key properties of 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]?
6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine] has a molecular weight of 217.31 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxyspiro[1,2-dihydroindene-3,4'-piperidine] is sourced from PubChem (CID 82277020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).