(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine

C24H27N — CID 11602364

IUPAC(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine
SMILESCc1ccc(-c2ccc3cc(CCN4CCC[C@H]4C)ccc3c2)cc1
InChIInChI=1S/C24H27N/c1-18-5-8-21(9-6-18)23-12-11-22-16-20(7-10-24(22)17-23)13-15-25-14-3-4-19(25)2/h5-12,16-17,19H,3-4,13-15H2,1-2H3/t19-/m1/s1
InChIKeyPDCYYDCPOXJRRJ-LJQANCHMSA-N
MW329.49 g/mol
LogP5.84
Rot. Bonds4

About (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine

(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine (PubChem CID 11602364) has the molecular formula C24H27N and a molecular weight of 329.49 g/mol. Its IUPAC name is (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine
PubChem CID11602364
Molecular FormulaC24H27N
Molecular Weight329.49 g/mol
Exact Mass329.21
IUPAC Name(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine
SMILESCc1ccc(-c2ccc3cc(CCN4CCC[C@H]4C)ccc3c2)cc1
InChIInChI=1S/C24H27N/c1-18-5-8-21(9-6-18)23-12-11-22-16-20(7-10-24(22)17-23)13-15-25-14-3-4-19(25)2/h5-12,16-17,19H,3-4,13-15H2,1-2H3/t19-/m1/s1
InChIKeyPDCYYDCPOXJRRJ-LJQANCHMSA-N
XLogP5.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.49
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[6-[2-(2-methylpiperidin-1-yl)ethyl]naphthalen-2-yl]benzonitrile
CID 57418062
3-chloro-6-[6-[2-(2-methylpyrrolidin-1-yl)ethyl]naphthalen-2-yl]pyridazine
CID 76529530
2-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]naphthalen-2-yl]-1,3-thiazole
CID 52917809
[5-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]isoindol-2-yl]-(oxan-4-yl)methanone
CID 68782789
2-(6-chloro-3-pyridinyl)-6-[2-(2-methylpyrrolidin-1-yl)ethyl]quinoline
CID 87964253
2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-6-pyridin-4-ylquinoline
CID 10064429
2-(3,5-dimethyl-1H-pyrazol-4-yl)-6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]quinoline
CID 25156750
4-[6-[2-[2-(diethylamino)pyrrolidin-1-yl]ethyl]naphthalen-2-yl]benzonitrile
CID 10046373
4-[3-[2-[(2S)-2-methylpyrrolidin-1-yl]ethyl]isoquinolin-7-yl]benzonitrile
CID 10088709
(2R)-1-[2-[4-[4-(aziridin-1-ylsulfonyl)phenyl]phenyl]ethyl]-2-methylpyrrolidine
CID 24886607
4-[4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]phenyl]-1,3-dioxol-2-one
CID 141238596
2-hydroxy-1-[5-[4-[2-(2-methylpyrrolidin-1-yl)ethyl]phenyl]-1,3-dihydroisoindol-2-yl]ethanone
CID 68783904

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine?
The IUPAC name of (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine (CID 11602364) is (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine.
What is the SMILES notation for (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine?
The canonical SMILES for (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine is Cc1ccc(-c2ccc3cc(CCN4CCC[C@H]4C)ccc3c2)cc1.
What is the InChIKey of (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine?
The InChIKey is PDCYYDCPOXJRRJ-LJQANCHMSA-N. The full InChI is InChI=1S/C24H27N/c1-18-5-8-21(9-6-18)23-12-11-22-16-20(7-10-24(22)17-23)13-15-25-14-3-4-19(25)2/h5-12,16-17,19H,3-4,13-15H2,1-2H3/t19-/m1/s1.
What are the key properties of (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine?
(2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine has a molecular weight of 329.49 g/mol, XLogP of 5.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-[2-[6-(4-methylphenyl)naphthalen-2-yl]ethyl]pyrrolidine is sourced from PubChem (CID 11602364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).