3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine

C16H19N — CID 23396966

IUPAC3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
SMILESCC1CCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C16H19N/c1-13-9-10-17(11-13)12-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,13H,9-12H2,1H3
InChIKeyFMUPSHGPUSYEJO-UHFFFAOYSA-N
MW225.34 g/mol
LogP3.68
Rot. Bonds2

About 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine

3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine (PubChem CID 23396966) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine.

Molecular Properties

Compound Name3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
PubChem CID23396966
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
SMILESCC1CCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C16H19N/c1-13-9-10-17(11-13)12-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,13H,9-12H2,1H3
InChIKeyFMUPSHGPUSYEJO-UHFFFAOYSA-N
XLogP3.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-(naphthalen-1-ylmethyl)pyrrolidin-3-amine
CID 62369278
3-bromo-1-(naphthalen-1-ylmethyl)pyrrolidine
CID 80675511
(3S)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-amine
CID 10680771
(3R)-1-(naphthalen-1-ylmethyl)pyrrolidin-3-ol
CID 10823187
N,3-dimethyl-1-(naphthalen-1-ylmethyl)piperidin-4-amine
CID 62369775
1-[1-(naphthalen-1-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630234
3-ethyl-1-(naphthalen-1-ylmethyl)piperidin-4-ol
CID 114511208
3-(naphthalen-1-ylmethyl)-3,9-diazabicyclo[4.2.1]nonane
CID 81495523
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
N-methyl-1-(naphthalen-1-ylmethyl)piperidin-3-amine
CID 62536724
4-methyl-1-[1-(naphthalen-1-ylmethyl)piperidin-4-yl]piperidine;oxalic acid
CID 2911508
3-chloro-1-(naphthalen-1-ylmethyl)piperidine
CID 55182607

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine?
The IUPAC name of 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine (CID 23396966) is 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine.
What is the SMILES notation for 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine?
The canonical SMILES for 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine is CC1CCN(Cc2cccc3ccccc23)C1.
What is the InChIKey of 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine?
The InChIKey is FMUPSHGPUSYEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-13-9-10-17(11-13)12-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,13H,9-12H2,1H3.
What are the key properties of 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine?
3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine has a molecular weight of 225.34 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine is sourced from PubChem (CID 23396966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).