1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]

C12H16N2O — CID 90842756

IUPAC1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]
SMILESCN1CCC2(CC1)OCc1ncccc12
InChIInChI=1S/C12H16N2O/c1-14-7-4-12(5-8-14)10-3-2-6-13-11(10)9-15-12/h2-3,6H,4-5,7-9H2,1H3
InChIKeyBJWLACHDBTTZJS-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.53
Rot. Bonds

About 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]

1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine] (PubChem CID 90842756) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine].

Molecular Properties

Compound Name1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]
PubChem CID90842756
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]
SMILESCN1CCC2(CC1)OCc1ncccc12
InChIInChI=1S/C12H16N2O/c1-14-7-4-12(5-8-14)10-3-2-6-13-11(10)9-15-12/h2-3,6H,4-5,7-9H2,1H3
InChIKeyBJWLACHDBTTZJS-UHFFFAOYSA-N
XLogP1.53
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1'-oxidospiro[7H-furo[3,4-b]pyridine-5,3'-pyrrolidine]
CID 87227698
2'-spiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]-1'-ylspiro[1,3-dihydroindene-2,5'-1,3-oxazole]-4'-one
CID 123720883
1'-methyl-2-methylidenespiro[1H-pyrido[2,3-d][1,3]oxazine-4,4'-piperidine]
CID 134278064
7,7-dimethyl-5,8-dihydropyrano[4,3-b]pyridine
CID 167037500
1'-ethylspiro[1H-2-benzofuran-3,4'-piperidine]
CID 10036300
6-methoxy-1'-(3-methyl-2-pyridinyl)spiro[3,4-dihydroisochromene-1,4'-piperidine]
CID 135103863
N-methyl-2-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-yl-N-(2-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylethyl)ethanamine
CID 18700233
1'-pyridin-2-ylspiro[5H-furo[3,4-b]pyridine-7,4'-piperidine]
CID 175717906
1'-(2,3-dichloro-4-pyridinyl)spiro[1H-2-benzofuran-3,4'-piperidine]
CID 57470420
[6-chloro-1-[[(2S)-pyrrolidin-2-yl]methyl]indol-3-yl]-spiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]-1'-ylmethanone;dihydrochloride
CID 25001925
1'-phenylspiro[1H-2-benzofuran-3,4'-piperidine]
CID 86733482
tert-butyl (2S)-2-[[6-chloro-3-(spiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]-1'-carbonyl)indol-1-yl]methyl]pyrrolidine-1-carboxylate
CID 25001924

Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]?
The IUPAC name of 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine] (CID 90842756) is 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine].
What is the SMILES notation for 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]?
The canonical SMILES for 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine] is CN1CCC2(CC1)OCc1ncccc12.
What is the InChIKey of 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]?
The InChIKey is BJWLACHDBTTZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-14-7-4-12(5-8-14)10-3-2-6-13-11(10)9-15-12/h2-3,6H,4-5,7-9H2,1H3.
What are the key properties of 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine]?
1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine] has a molecular weight of 204.27 g/mol, XLogP of 1.53, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[7H-furo[3,4-b]pyridine-5,4'-piperidine] is sourced from PubChem (CID 90842756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).