2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline

C24H18N2 — CID 50941583

IUPAC2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline
SMILESCc1cc2c(-c3ccccc3)c(-c3ccccc3)c3ccccc3n2n1
InChIInChI=1S/C24H18N2/c1-17-16-22-24(19-12-6-3-7-13-19)23(18-10-4-2-5-11-18)20-14-8-9-15-21(20)26(22)25-17/h2-16H,1H3
InChIKeyMTJCMEMVQOZQIF-UHFFFAOYSA-N
MW334.42 g/mol
LogP6.13
Rot. Bonds2

About 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline

2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline (PubChem CID 50941583) has the molecular formula C24H18N2 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline.

Molecular Properties

Compound Name2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline
PubChem CID50941583
Molecular FormulaC24H18N2
Molecular Weight334.42 g/mol
Exact Mass334.15
IUPAC Name2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline
SMILESCc1cc2c(-c3ccccc3)c(-c3ccccc3)c3ccccc3n2n1
InChIInChI=1S/C24H18N2/c1-17-16-22-24(19-12-6-3-7-13-19)23(18-10-4-2-5-11-18)20-14-8-9-15-21(20)26(22)25-17/h2-16H,1H3
InChIKeyMTJCMEMVQOZQIF-UHFFFAOYSA-N
XLogP6.13
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.42
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-chloro-2,5-dimethyl-6-phenylpyrazolo[1,5-a]pyrimidine
CID 82274571
10-methyl-14,21-diphenyl-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
CID 58131761
1-methyl-2,3-diphenylindole
CID 11426096
2-methyl-N-[(1S)-1-phenylethyl]pyrazolo[1,5-a]quinazolin-5-amine
CID 8892490
8-(2,4-dimethylphenyl)-2-methylpyrazolo[1,5-f]phenanthridine
CID 59359208
5-chloro-2-phenylpyrazolo[1,5-a]quinazoline
CID 73334175
4,5-diphenylimidazo[1,2-a]quinoline
CID 135058439
2-iodo-1-methyl-3-phenylindole
CID 76846489
9-[4-[10-(3,5-dimethylphenyl)anthracen-9-yl]phenyl]carbazole;9-[4-[10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 162257704
12,26-bis(4-methylphenyl)-2,16-diphenyl-12,26-diazaheptacyclo[15.11.0.03,15.05,13.06,11.019,27.020,25]octacosa-1,3(15),4,6,8,10,13,16,18,20,22,24,27-tridecaene
CID 123155033
3-[10-(4-methylphenyl)anthracen-9-yl]-9-(4-phenylphenyl)carbazole
CID 143844267
9-(10-phenylanthracen-9-yl)-3-[9-(10-phenylanthracen-9-yl)carbazol-3-yl]carbazole
CID 168729209

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline?
The IUPAC name of 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline (CID 50941583) is 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline.
What is the SMILES notation for 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline?
The canonical SMILES for 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline is Cc1cc2c(-c3ccccc3)c(-c3ccccc3)c3ccccc3n2n1.
What is the InChIKey of 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline?
The InChIKey is MTJCMEMVQOZQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2/c1-17-16-22-24(19-12-6-3-7-13-19)23(18-10-4-2-5-11-18)20-14-8-9-15-21(20)26(22)25-17/h2-16H,1H3.
What are the key properties of 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline?
2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline has a molecular weight of 334.42 g/mol, XLogP of 6.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,5-diphenylpyrazolo[1,5-a]quinoline is sourced from PubChem (CID 50941583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).