1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]

C15H23N — CID 142832401

IUPAC1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]
SMILESCN1CCC2(CCCC3=CCCC=C32)CC1
InChIInChI=1S/C15H23N/c1-16-11-9-15(10-12-16)8-4-6-13-5-2-3-7-14(13)15/h5,7H,2-4,6,8-12H2,1H3
InChIKeyZWGRHLULQBSUBL-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.53
Rot. Bonds

About 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]

1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] (PubChem CID 142832401) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine].

Molecular Properties

Compound Name1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]
PubChem CID142832401
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]
SMILESCN1CCC2(CCCC3=CCCC=C32)CC1
InChIInChI=1S/C15H23N/c1-16-11-9-15(10-12-16)8-4-6-13-5-2-3-7-14(13)15/h5,7H,2-4,6,8-12H2,1H3
InChIKeyZWGRHLULQBSUBL-UHFFFAOYSA-N
XLogP3.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] with MolForge

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Related Compounds

4,9-dimethyl-5-propan-2-yl-9-azaspiro[5.6]dodec-4-ene;ethane
CID 177162070
5'-methylspiro[1,2,5,6-tetrahydroindene-3,3'-1,2-dihydroindene]
CID 143183690
5,8-ditert-butyl-1'-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 118314320
6-(cyclohexen-1-yl)-1,6-di(cyclopenten-1-yl)cyclohexene
CID 141056447
9-methyl-2,9-diazaspiro[4.6]undecane-1,3-dione
CID 65071381
1'-methylspiro[3,4-dihydronaphthalene-2,4'-piperidine]-1-one
CID 10263215
7-methyl-7-azaspiro[4.5]decan-4-one;hydrochloride
CID 121207632
1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 143568861
3-(cyclohepten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650886
3-methyl-3-azaspiro[5.12]octadecane
CID 71021122
3-methyl-3-azaspiro[5.9]pentadecane
CID 170128255
2-(cyclohexen-1-yl)-1,7,7-trimethylbicyclo[2.2.1]hept-2-ene
CID 156785118

Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]?
The IUPAC name of 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] (CID 142832401) is 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine].
What is the SMILES notation for 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]?
The canonical SMILES for 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] is CN1CCC2(CCCC3=CCCC=C32)CC1.
What is the InChIKey of 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]?
The InChIKey is ZWGRHLULQBSUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-16-11-9-15(10-12-16)8-4-6-13-5-2-3-7-14(13)15/h5,7H,2-4,6,8-12H2,1H3.
What are the key properties of 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine]?
1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] has a molecular weight of 217.36 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[2,3,6,7-tetrahydro-1H-naphthalene-4,4'-piperidine] is sourced from PubChem (CID 142832401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).