1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]

C14H19NO — CID 143568861

IUPAC1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
SMILESCON1CCC2(CCCc3ccccc32)C1
InChIInChI=1S/C14H19NO/c1-16-15-10-9-14(11-15)8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7H,4,6,8-11H2,1H3
InChIKeyDPVIFYYXRBYYJX-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.53
Rot. Bonds1

About 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]

1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine] (PubChem CID 143568861) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine].

Molecular Properties

Compound Name1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
PubChem CID143568861
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
SMILESCON1CCC2(CCCc3ccccc32)C1
InChIInChI=1S/C14H19NO/c1-16-15-10-9-14(11-15)8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7H,4,6,8-11H2,1H3
InChIKeyDPVIFYYXRBYYJX-UHFFFAOYSA-N
XLogP2.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1'-[(4-methoxyphenyl)methyl]spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
CID 15163149
1'-(cyclopropylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine];hydrochloride
CID 54586714
spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-1'-carboxamide
CID 127437163
spiro[2,3-dihydro-1H-naphthalene-4,3'-2,4-dihydro-1H-naphthalene]
CID 56653224
[4-(methoxymethyl)-1-methylpyrrol-2-yl]-spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-1'-ylmethanone
CID 166373453
1'-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
CID 59433508
1'-(piperidin-4-ylmethyl)spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine];hydrochloride
CID 119932289
(6-methoxypyrimidin-4-yl)-spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-1'-ylmethanone
CID 136564429
(3S)-3-amino-1-[(4R)-spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-1'-yl]butan-1-one
CID 129466127
pyrrolidin-2-yl(spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-1'-yl)methanone;hydrochloride
CID 119340083
(4R)-spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 86311934
(1-methylpyrazol-4-yl)-[(4S)-spiro[2,3-dihydro-1H-naphthalene-4,3'-piperidine]-1'-yl]methanone
CID 124886336

Frequently Asked Questions

What is the IUPAC name of 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]?
The IUPAC name of 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine] (CID 143568861) is 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine].
What is the SMILES notation for 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]?
The canonical SMILES for 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine] is CON1CCC2(CCCc3ccccc32)C1.
What is the InChIKey of 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]?
The InChIKey is DPVIFYYXRBYYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-15-10-9-14(11-15)8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7H,4,6,8-11H2,1H3.
What are the key properties of 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]?
1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine] has a molecular weight of 217.31 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine] is sourced from PubChem (CID 143568861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).