3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole

C15H15N — CID 101496554

IUPAC3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole
SMILESCC1CN=C(c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H15N/c1-11-8-15(16-10-11)14-7-6-12-4-2-3-5-13(12)9-14/h2-7,9,11H,8,10H2,1H3
InChIKeySENTYMQGFMIDCS-UHFFFAOYSA-N
MW209.29 g/mol
LogP3.67
Rot. Bonds1

About 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole

3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole (PubChem CID 101496554) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole.

Molecular Properties

Compound Name3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole
PubChem CID101496554
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC Name3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole
SMILESCC1CN=C(c2ccc3ccccc3c2)C1
InChIInChI=1S/C15H15N/c1-11-8-15(16-10-11)14-7-6-12-4-2-3-5-13(12)9-14/h2-7,9,11H,8,10H2,1H3
InChIKeySENTYMQGFMIDCS-UHFFFAOYSA-N
XLogP3.67
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-3-naphthalen-2-yl-4,5-dihydro-1,2-oxazole
CID 23643899
2-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole-3-carbonitrile
CID 171976234
3-(dichloromethyl)-2-methyl-5-naphthalen-2-yl-3,4-dihydropyrazole
CID 101353548
2-(3-bromo-5-methylcyclohexa-1,3-dien-1-yl)naphthalene
CID 90231486
5-(2,6-difluorophenyl)-3-methyl-3,4-dihydro-2H-pyrrole
CID 142128899
2-naphthalen-2-yl-5-propan-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
CID 3333129
(3R)-3-(4-methoxyphenyl)-2-methyl-5-naphthalen-2-yl-3,4-dihydropyrazole
CID 6925478
(5S)-5-benzyl-3-naphthalen-2-yl-4,5-dihydro-1,2-oxazole
CID 71561705
benzo[f]azulene
CID 13065869
4',9-dimethyl-2-naphthalen-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,1'-cyclohexane]
CID 5029322
(3S)-3-[4-(dimethylamino)phenyl]-5-naphthalen-2-yl-3,4-dihydropyrazole-2-carbaldehyde
CID 765180
2-amino-4-(4-methylpiperidin-1-yl)-6-naphthalen-2-ylpyridine-3-carbonitrile
CID 11824071

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole?
The IUPAC name of 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole (CID 101496554) is 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole.
What is the SMILES notation for 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole?
The canonical SMILES for 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole is CC1CN=C(c2ccc3ccccc3c2)C1.
What is the InChIKey of 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole?
The InChIKey is SENTYMQGFMIDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N/c1-11-8-15(16-10-11)14-7-6-12-4-2-3-5-13(12)9-14/h2-7,9,11H,8,10H2,1H3.
What are the key properties of 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole?
3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole has a molecular weight of 209.29 g/mol, XLogP of 3.67, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-naphthalen-2-yl-3,4-dihydro-2H-pyrrole is sourced from PubChem (CID 101496554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).