3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride

C20H21ClN4O2 — CID 18691086

IUPAC3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride
SMILESCOc1ccc(-c2ncc3n2CN(C(=O)N(C)C)c2ccccc2-3)cc1.Cl
InChIInChI=1S/C20H20N4O2.ClH/c1-22(2)20(25)24-13-23-18(16-6-4-5-7-17(16)24)12-21-19(23)14-8-10-15(26-3)11-9-14;/h4-12H,13H2,1-3H3;1H
InChIKeySKKCFUPSZZSNFD-UHFFFAOYSA-N
MW384.87 g/mol
LogP4.11
Rot. Bonds2

About 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride

3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride (PubChem CID 18691086) has the molecular formula C20H21ClN4O2 and a molecular weight of 384.87 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride
PubChem CID18691086
Molecular FormulaC20H21ClN4O2
Molecular Weight384.87 g/mol
Exact Mass384.14
IUPAC Name3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride
SMILESCOc1ccc(-c2ncc3n2CN(C(=O)N(C)C)c2ccccc2-3)cc1.Cl
InChIInChI=1S/C20H20N4O2.ClH/c1-22(2)20(25)24-13-23-18(16-6-4-5-7-17(16)24)12-21-19(23)14-8-10-15(26-3)11-9-14;/h4-12H,13H2,1-3H3;1H
InChIKeySKKCFUPSZZSNFD-UHFFFAOYSA-N
XLogP4.11
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.87
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride?
The IUPAC name of 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride (CID 18691086) is 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride.
What is the SMILES notation for 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride?
The canonical SMILES for 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride is COc1ccc(-c2ncc3n2CN(C(=O)N(C)C)c2ccccc2-3)cc1.Cl.
What is the InChIKey of 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride?
The InChIKey is SKKCFUPSZZSNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2.ClH/c1-22(2)20(25)24-13-23-18(16-6-4-5-7-17(16)24)12-21-19(23)14-8-10-15(26-3)11-9-14;/h4-12H,13H2,1-3H3;1H.
What are the key properties of 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride?
3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride has a molecular weight of 384.87 g/mol, XLogP of 4.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride is sourced from PubChem (CID 18691086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).