2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline

C23H21N5 — CID 50993859

IUPAC2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline
SMILESCc1cc2c3ccccc3nc(CCc3nc(-c4ccccc4)cn3C)n2n1
InChIInChI=1S/C23H21N5/c1-16-14-21-18-10-6-7-11-19(18)24-23(28(21)26-16)13-12-22-25-20(15-27(22)2)17-8-4-3-5-9-17/h3-11,14-15H,12-13H2,1-2H3
InChIKeyJTZGSTGVCPECEB-UHFFFAOYSA-N
MW367.46 g/mol
LogP4.38
Rot. Bonds4

About 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline

2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline (PubChem CID 50993859) has the molecular formula C23H21N5 and a molecular weight of 367.46 g/mol. Its IUPAC name is 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline.

Molecular Properties

Compound Name2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline
PubChem CID50993859
Molecular FormulaC23H21N5
Molecular Weight367.46 g/mol
Exact Mass367.18
IUPAC Name2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline
SMILESCc1cc2c3ccccc3nc(CCc3nc(-c4ccccc4)cn3C)n2n1
InChIInChI=1S/C23H21N5/c1-16-14-21-18-10-6-7-11-19(18)24-23(28(21)26-16)13-12-22-25-20(15-27(22)2)17-8-4-3-5-9-17/h3-11,14-15H,12-13H2,1-2H3
InChIKeyJTZGSTGVCPECEB-UHFFFAOYSA-N
XLogP4.38
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.46
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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6-(Difluoro(6-(1-methyl-1H-pyrazol-4-yl)-1,2,4-triazolo(4,3-b)pyridazin-3-yl)methyl)quinoline
CID 46911863
Pf-05180999
CID 60143346
CR-4056
CID 24898732
N6,N6-dimethyl-N4-[1-(phenylmethyl)-5-indazolyl]pyrido[3,4-d]pyrimidine-4,6-diamine
CID 6603857
Fazadinium Bromide
CID 6321422
FK-739 free acid
CID 9801627
Asp-2535
CID 9800113

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline?
The IUPAC name of 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline (CID 50993859) is 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline.
What is the SMILES notation for 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline?
The canonical SMILES for 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline is Cc1cc2c3ccccc3nc(CCc3nc(-c4ccccc4)cn3C)n2n1.
What is the InChIKey of 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline?
The InChIKey is JTZGSTGVCPECEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5/c1-16-14-21-18-10-6-7-11-19(18)24-23(28(21)26-16)13-12-22-25-20(15-27(22)2)17-8-4-3-5-9-17/h3-11,14-15H,12-13H2,1-2H3.
What are the key properties of 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline?
2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline has a molecular weight of 367.46 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]pyrazolo[1,5-c]quinazoline is sourced from PubChem (CID 50993859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).