2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine

C14H19N — CID 13350945

IUPAC2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine
SMILESc1ccc2c(c1)CCCC2C1CCCN1
InChIInChI=1S/C14H19N/c1-2-7-12-11(5-1)6-3-8-13(12)14-9-4-10-15-14/h1-2,5,7,13-15H,3-4,6,8-10H2
InChIKeyFZCLJELINMIBEH-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.86
Rot. Bonds1

About 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine

2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine (PubChem CID 13350945) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine.

Molecular Properties

Compound Name2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine
PubChem CID13350945
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine
SMILESc1ccc2c(c1)CCCC2C1CCCN1
InChIInChI=1S/C14H19N/c1-2-7-12-11(5-1)6-3-8-13(12)14-9-4-10-15-14/h1-2,5,7,13-15H,3-4,6,8-10H2
InChIKeyFZCLJELINMIBEH-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1,2,3,4-tetrahydronaphthalen-1-yl)azepane
CID 55111676
(2R)-2-[(1R)-2,3-dihydro-1H-inden-1-yl]pyrrolidine
CID 125041313
2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,4-diazepane
CID 67829794
(2S)-2-[(1S)-1,3,4,5-tetrahydro-2-benzoxepin-1-yl]pyrrolidine
CID 122456694
(2R)-2-[(4R)-4,5,6,7-tetrahydro-1-benzothiophen-4-yl]pyrrolidine
CID 129015917
(4aS,7aS)-6-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678936
8-pyrrolidin-2-yl-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 118008523
1-cyclohex-2-en-1-yl-1,2,3,4-tetrahydronaphthalene
CID 123727569
1,2,2a,3,4,8b-hexahydrocyclobuta[c]isoquinoline
CID 154316828
N-[[(2S)-pyrrolidin-2-yl]methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 143330144
(4aS,10bR)-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-9-carbonitrile
CID 86654076
(4aS,7aS)-6-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678925

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine?
The IUPAC name of 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine (CID 13350945) is 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine.
What is the SMILES notation for 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine?
The canonical SMILES for 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine is c1ccc2c(c1)CCCC2C1CCCN1.
What is the InChIKey of 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine?
The InChIKey is FZCLJELINMIBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-2-7-12-11(5-1)6-3-8-13(12)14-9-4-10-15-14/h1-2,5,7,13-15H,3-4,6,8-10H2.
What are the key properties of 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine?
2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine has a molecular weight of 201.31 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine is sourced from PubChem (CID 13350945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).