4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline

C21H20N4 — CID 71543930

IUPAC4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline
SMILESCc1nc(CCc2nc(-c3ccccc3)cn2C)nc2ccccc12
InChIInChI=1S/C21H20N4/c1-15-17-10-6-7-11-18(17)23-20(22-15)12-13-21-24-19(14-25(21)2)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3
InChIKeyBVTPSZCCHKYCRW-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.12
Rot. Bonds4

About 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline

4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline (PubChem CID 71543930) has the molecular formula C21H20N4 and a molecular weight of 328.42 g/mol. Its IUPAC name is 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline.

Molecular Properties

Compound Name4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline
PubChem CID71543930
Molecular FormulaC21H20N4
Molecular Weight328.42 g/mol
Exact Mass328.17
IUPAC Name4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline
SMILESCc1nc(CCc2nc(-c3ccccc3)cn2C)nc2ccccc12
InChIInChI=1S/C21H20N4/c1-15-17-10-6-7-11-18(17)23-20(22-15)12-13-21-24-19(14-25(21)2)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3
InChIKeyBVTPSZCCHKYCRW-UHFFFAOYSA-N
XLogP4.12
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Imiquimod
CID 57469
2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
2-Amino-3-methylimidazo(4,5-f)quinoline
CID 53462
2-Amino-3,4-dimethylimidazo(4,5-f)quinoline
CID 62274
Mavorixafor
CID 11256587
Quinazoline
CID 9210
2-Amino-3,4,8-trimethylimidazo(4,5-f)quinoxaline
CID 104739
4-(1-(cyclopropylmethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)pyrimidin-2-amine
CID 5172
PF-670462
CID 51049607
CR-4056
CID 24898732
7-(1-Ethyl-propyl)-7H-pyrrolo-[3,2-F]quinazoline-1,3-diamine
CID 1881
4-[5-[2-(1-phenyl-ethylamino)-pyrimidin-4-yl]-1-methyl-4-(3-trifluoromethylphenyl)-1H-imidazol-2-yl]-piperidine
CID 447721

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline?
The IUPAC name of 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline (CID 71543930) is 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline.
What is the SMILES notation for 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline?
The canonical SMILES for 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline is Cc1nc(CCc2nc(-c3ccccc3)cn2C)nc2ccccc12.
What is the InChIKey of 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline?
The InChIKey is BVTPSZCCHKYCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4/c1-15-17-10-6-7-11-18(17)23-20(22-15)12-13-21-24-19(14-25(21)2)16-8-4-3-5-9-16/h3-11,14H,12-13H2,1-2H3.
What are the key properties of 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline?
4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline has a molecular weight of 328.42 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline is sourced from PubChem (CID 71543930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).