[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone

C22H22N4O2 — CID 18691089

IUPAC[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone
SMILESCOc1cccc(-c2ncc3n2CN(C(=O)N2CCCC2)c2ccccc2-3)c1
InChIInChI=1S/C22H22N4O2/c1-28-17-8-6-7-16(13-17)21-23-14-20-18-9-2-3-10-19(18)26(15-25(20)21)22(27)24-11-4-5-12-24/h2-3,6-10,13-14H,4-5,11-12,15H2,1H3
InChIKeyTVOHRFHMRUVKSK-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.22
Rot. Bonds2

About [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone

[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone (PubChem CID 18691089) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone
PubChem CID18691089
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone
SMILESCOc1cccc(-c2ncc3n2CN(C(=O)N2CCCC2)c2ccccc2-3)c1
InChIInChI=1S/C22H22N4O2/c1-28-17-8-6-7-16(13-17)21-23-14-20-18-9-2-3-10-19(18)26(15-25(20)21)22(27)24-11-4-5-12-24/h2-3,6-10,13-14H,4-5,11-12,15H2,1H3
InChIKeyTVOHRFHMRUVKSK-UHFFFAOYSA-N
XLogP4.22
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone with MolForge

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Related Compounds

3-(4-methoxyphenyl)-N,N-dimethyl-5H-imidazo[1,5-c]quinazoline-6-carboxamide;hydrochloride
CID 18691086
methyl 3-(3-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-8-carboxylate
CID 117249954
(4-methoxyphenyl)-[5-(3-methoxyphenyl)-3,6,11-triazatricyclo[7.3.0.02,6]dodeca-2,4-dien-11-yl]methanone
CID 131673242
[2-(3-methoxyphenyl)quinolin-4-yl]-piperidin-1-ylmethanone
CID 896066
[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-pyrrolidin-1-ylmethanone
CID 22427421
cyclopentyl-[(3R)-3-[3-(3-methoxyphenyl)pyrazin-2-yl]piperidin-1-yl]methanone
CID 95819187
5-(3-methoxyphenyl)-2-methyl-1,3-oxazole
CID 67394978
2-[[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-ylethanone
CID 29253524
cyclobutyl-[(3R)-3-[6-(3-methoxyphenyl)-2-pyridinyl]piperidin-1-yl]methanone
CID 95809673
azepan-1-yl-(3-methoxyphenyl)methanone
CID 669437
3-(3-methoxyphenyl)pyridine-2-carboxylic acid
CID 52983911
3-(3-methoxyphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 117152061

Frequently Asked Questions

What is the IUPAC name of [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone (CID 18691089) is [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone is COc1cccc(-c2ncc3n2CN(C(=O)N2CCCC2)c2ccccc2-3)c1.
What is the InChIKey of [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is TVOHRFHMRUVKSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-28-17-8-6-7-16(13-17)21-23-14-20-18-9-2-3-10-19(18)26(15-25(20)21)22(27)24-11-4-5-12-24/h2-3,6-10,13-14H,4-5,11-12,15H2,1H3.
What are the key properties of [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone?
[3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 374.44 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methoxyphenyl)-5H-imidazo[1,5-c]quinazolin-6-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 18691089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).