2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole

C18H22N4O2 — CID 95893804

IUPAC2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole
SMILESCOc1cccc(-c2nccn2[C@H](C)Cc2cc(C)[nH]n2)c1OC
InChIInChI=1S/C18H22N4O2/c1-12-10-14(21-20-12)11-13(2)22-9-8-19-18(22)15-6-5-7-16(23-3)17(15)24-4/h5-10,13H,11H2,1-4H3,(H,20,21)/t13-/m1/s1
InChIKeyWRCMYBZAGGRNQV-CYBMUJFWSA-N
MW326.40 g/mol
LogP3.40
Rot. Bonds6

About 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole

2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole (PubChem CID 95893804) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole.

Molecular Properties

Compound Name2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole
PubChem CID95893804
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole
SMILESCOc1cccc(-c2nccn2[C@H](C)Cc2cc(C)[nH]n2)c1OC
InChIInChI=1S/C18H22N4O2/c1-12-10-14(21-20-12)11-13(2)22-9-8-19-18(22)15-6-5-7-16(23-3)17(15)24-4/h5-10,13H,11H2,1-4H3,(H,20,21)/t13-/m1/s1
InChIKeyWRCMYBZAGGRNQV-CYBMUJFWSA-N
XLogP3.40
TPSA64.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-[3-methoxy-2-[(3-methylphenyl)methoxy]phenyl]-1-methylimidazole
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1-[1-(2,6-dimethoxyphenyl)ethyl]-2-methylimidazole
CID 70489774
3,12-bis(2,3-dimethoxyphenyl)-1,2,4,5,7,8,10,11-octazatricyclo[7.3.0.02,6]dodeca-3,5,7,9,11-pentaene
CID 156905120
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5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole
CID 56897341
1-[3-(1-methylimidazol-2-yl)phenyl]-3-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]urea
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CID 162638690
3-(2,3-dimethoxyphenyl)-4,5-dimethyl-1H-pyridazin-6-one
CID 106521195
1-[2-[(2-methoxyphenyl)methyl]pyrazol-3-yl]-3-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]urea
CID 118781085
(6R)-6-[2-(5-fluoro-2-methoxyphenyl)imidazol-1-yl]-2-methylheptan-2-ol
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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole?
The IUPAC name of 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole (CID 95893804) is 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole.
What is the SMILES notation for 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole?
The canonical SMILES for 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole is COc1cccc(-c2nccn2[C@H](C)Cc2cc(C)[nH]n2)c1OC.
What is the InChIKey of 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole?
The InChIKey is WRCMYBZAGGRNQV-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-12-10-14(21-20-12)11-13(2)22-9-8-19-18(22)15-6-5-7-16(23-3)17(15)24-4/h5-10,13H,11H2,1-4H3,(H,20,21)/t13-/m1/s1.
What are the key properties of 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole?
2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole has a molecular weight of 326.40 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethoxyphenyl)-1-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]imidazole is sourced from PubChem (CID 95893804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).