1-(4-methylnaphthalen-2-yl)pyrrolidine

C15H17N — CID 102172515

IUPAC1-(4-methylnaphthalen-2-yl)pyrrolidine
SMILESCc1cc(N2CCCC2)cc2ccccc12
InChIInChI=1S/C15H17N/c1-12-10-14(16-8-4-5-9-16)11-13-6-2-3-7-15(12)13/h2-3,6-7,10-11H,4-5,8-9H2,1H3
InChIKeyFGOOVCGRVATBTA-UHFFFAOYSA-N
MW211.31 g/mol
LogP3.75
Rot. Bonds1

About 1-(4-methylnaphthalen-2-yl)pyrrolidine

1-(4-methylnaphthalen-2-yl)pyrrolidine (PubChem CID 102172515) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(4-methylnaphthalen-2-yl)pyrrolidine.

Molecular Properties

Compound Name1-(4-methylnaphthalen-2-yl)pyrrolidine
PubChem CID102172515
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name1-(4-methylnaphthalen-2-yl)pyrrolidine
SMILESCc1cc(N2CCCC2)cc2ccccc12
InChIInChI=1S/C15H17N/c1-12-10-14(16-8-4-5-9-16)11-13-6-2-3-7-15(12)13/h2-3,6-7,10-11H,4-5,8-9H2,1H3
InChIKeyFGOOVCGRVATBTA-UHFFFAOYSA-N
XLogP3.75
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-3-(4-methylnaphthalen-2-yl)naphthalene
CID 58049667
1-(10-pyrrolidin-1-ylpicen-3-yl)pyrrolidine
CID 58426575
1,3-dimethylnaphthalene;ethane
CID 145447624
3-iodo-1-methylnaphthalene
CID 11715949
3-bromo-1-methylnaphthalene
CID 18673607
1,3-bis(1,3-dimethylnaphthalen-2-yl)imidazolidine
CID 68962519
2-methyl-4-pyrrolidin-1-ylbenzaldehyde
CID 958834
2-methyl-4-pyrrolidin-1-ylphenol;hydrobromide
CID 154577359
2-[4-(4-methylquinolin-2-yl)piperazin-1-yl]-3-pyrrolidin-1-ylquinoxaline
CID 108777261
9-methyl-3-pyrrolidin-1-ylcarbazole
CID 123822276
1-(4-naphthalen-1-ylphenyl)pyrrolidine
CID 168512103
[4-(azepan-1-yl)-2-methylphenyl]methanol
CID 62136548

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylnaphthalen-2-yl)pyrrolidine?
The IUPAC name of 1-(4-methylnaphthalen-2-yl)pyrrolidine (CID 102172515) is 1-(4-methylnaphthalen-2-yl)pyrrolidine.
What is the SMILES notation for 1-(4-methylnaphthalen-2-yl)pyrrolidine?
The canonical SMILES for 1-(4-methylnaphthalen-2-yl)pyrrolidine is Cc1cc(N2CCCC2)cc2ccccc12.
What is the InChIKey of 1-(4-methylnaphthalen-2-yl)pyrrolidine?
The InChIKey is FGOOVCGRVATBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-12-10-14(16-8-4-5-9-16)11-13-6-2-3-7-15(12)13/h2-3,6-7,10-11H,4-5,8-9H2,1H3.
What are the key properties of 1-(4-methylnaphthalen-2-yl)pyrrolidine?
1-(4-methylnaphthalen-2-yl)pyrrolidine has a molecular weight of 211.31 g/mol, XLogP of 3.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylnaphthalen-2-yl)pyrrolidine is sourced from PubChem (CID 102172515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).