4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine

C19H17BrN4O — CID 71680691

IUPAC4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine
SMILESCOc1ccc(C2(c3cccc(Br)c3)N=C(N)n3nc(C)cc32)cc1
InChIInChI=1S/C19H17BrN4O/c1-12-10-17-19(22-18(21)24(17)23-12,14-4-3-5-15(20)11-14)13-6-8-16(25-2)9-7-13/h3-11H,1-2H3,(H2,21,22)
InChIKeyNNEGGQTZBGBRHY-UHFFFAOYSA-N
MW397.28 g/mol
LogP3.43
Rot. Bonds3

About 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine

4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine (PubChem CID 71680691) has the molecular formula C19H17BrN4O and a molecular weight of 397.28 g/mol. Its IUPAC name is 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine.

Molecular Properties

Compound Name4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine
PubChem CID71680691
Molecular FormulaC19H17BrN4O
Molecular Weight397.28 g/mol
Exact Mass396.06
IUPAC Name4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine
SMILESCOc1ccc(C2(c3cccc(Br)c3)N=C(N)n3nc(C)cc32)cc1
InChIInChI=1S/C19H17BrN4O/c1-12-10-17-19(22-18(21)24(17)23-12,14-4-3-5-15(20)11-14)13-6-8-16(25-2)9-7-13/h3-11H,1-2H3,(H2,21,22)
InChIKeyNNEGGQTZBGBRHY-UHFFFAOYSA-N
XLogP3.43
TPSA65.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.28
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-5-(3-bromophenyl)-5-(4-methoxyphenyl)-3-methylimidazol-4-one
CID 25063366
(8R)-8-(3-bromophenyl)-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-6-amine
CID 129386819
3-(3-bromophenyl)-7-fluoro-3-(4-methoxyphenyl)isoindol-1-amine
CID 58579518
2-amino-5-(4-methoxyphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one
CID 141128111
2-amino-5-[3-(3-methoxyphenyl)phenyl]-3-methyl-5-(4-methylphenyl)imidazol-4-one;trifluoromethanethiol
CID 143463779
2-amino-3-cyclohexyl-5-(4-methoxyphenyl)-5-(3-pyridin-4-ylphenyl)imidazol-4-one
CID 86272415
2-amino-5-(3-bromophenyl)-3-methyl-5-(5-methylthiophen-3-yl)imidazol-4-one
CID 143389257
3-(4-methoxyphenyl)-3-[3-(5-methylfuran-2-yl)phenyl]isoindol-1-amine
CID 59596308
3-(3-bromophenyl)-3-(4-methoxy-3-methylphenyl)isoindol-1-amine
CID 59596275
2-amino-5-[3-(2-hydroxy-5-methoxyphenyl)phenyl]-3-methyl-5-phenylimidazol-4-one
CID 16750245
1-(3-bromophenyl)-3-(3-methoxyphenyl)pyrazol-5-amine
CID 43542770
6-amino-8-[3-(3,5-dichlorophenyl)phenyl]-8-(4-methoxyphenyl)-3,4-dihydro-2H-imidazo[1,5-a]pyrimidin-3-ol
CID 24873151

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine?
The IUPAC name of 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine (CID 71680691) is 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine.
What is the SMILES notation for 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine?
The canonical SMILES for 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine is COc1ccc(C2(c3cccc(Br)c3)N=C(N)n3nc(C)cc32)cc1.
What is the InChIKey of 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine?
The InChIKey is NNEGGQTZBGBRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17BrN4O/c1-12-10-17-19(22-18(21)24(17)23-12,14-4-3-5-15(20)11-14)13-6-8-16(25-2)9-7-13/h3-11H,1-2H3,(H2,21,22).
What are the key properties of 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine?
4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine has a molecular weight of 397.28 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromophenyl)-4-(4-methoxyphenyl)-2-methylimidazo[1,5-b]pyrazol-6-amine is sourced from PubChem (CID 71680691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).