5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole

C23H21N3 — CID 141382798

IUPAC5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole
SMILESc1ccc(-c2nc(N3CCCC3)[nH]c2-c2cccc3ccccc23)cc1
InChIInChI=1S/C23H21N3/c1-2-10-18(11-3-1)21-22(25-23(24-21)26-15-6-7-16-26)20-14-8-12-17-9-4-5-13-19(17)20/h1-5,8-14H,6-7,15-16H2,(H,24,25)
InChIKeySVUKXYCZMLWBEE-UHFFFAOYSA-N
MW339.44 g/mol
LogP5.50
Rot. Bonds3

About 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole

5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole (PubChem CID 141382798) has the molecular formula C23H21N3 and a molecular weight of 339.44 g/mol. Its IUPAC name is 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole.

Molecular Properties

Compound Name5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole
PubChem CID141382798
Molecular FormulaC23H21N3
Molecular Weight339.44 g/mol
Exact Mass339.17
IUPAC Name5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole
SMILESc1ccc(-c2nc(N3CCCC3)[nH]c2-c2cccc3ccccc23)cc1
InChIInChI=1S/C23H21N3/c1-2-10-18(11-3-1)21-22(25-23(24-21)26-15-6-7-16-26)20-14-8-12-17-9-4-5-13-19(17)20/h1-5,8-14H,6-7,15-16H2,(H,24,25)
InChIKeySVUKXYCZMLWBEE-UHFFFAOYSA-N
XLogP5.50
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.44
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)-5-methyl-4-phenyl-1H-pyrimidin-6-one
CID 136764405
1-(4-naphthalen-1-ylphenyl)pyrrolidine
CID 168512103
4-(5-naphthalen-1-yl-4-phenyl-1H-imidazol-2-yl)benzoate
CID 7030216
10-phenyl-5-piperidin-1-ylbenzo[h]quinoline
CID 102579281
6-chloro-5-phenyl-2-pyrrolidin-1-yl-1H-imidazo[4,5-b]pyridine
CID 176678688
3-naphthalen-1-yl-4-pyrrolidin-1-ylpyridine
CID 10754812
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
1-(5-naphthalen-1-yl-1,2,4-triazin-3-yl)azepane
CID 42508182
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
2-piperidin-1-yl-1H-quinazoline-4-thione
CID 53364718
5-bromo-4-naphthalen-1-yl-2-phenyl-1H-imidazole
CID 141189734

Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole?
The IUPAC name of 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole (CID 141382798) is 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole.
What is the SMILES notation for 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole?
The canonical SMILES for 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole is c1ccc(-c2nc(N3CCCC3)[nH]c2-c2cccc3ccccc23)cc1.
What is the InChIKey of 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole?
The InChIKey is SVUKXYCZMLWBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3/c1-2-10-18(11-3-1)21-22(25-23(24-21)26-15-6-7-16-26)20-14-8-12-17-9-4-5-13-19(17)20/h1-5,8-14H,6-7,15-16H2,(H,24,25).
What are the key properties of 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole?
5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole has a molecular weight of 339.44 g/mol, XLogP of 5.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-1-yl-4-phenyl-2-pyrrolidin-1-yl-1H-imidazole is sourced from PubChem (CID 141382798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).