4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol

C15H18N4O2 — CID 135884196

IUPAC4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol
SMILESCCCn1nc(C)c2[nH]c(-c3cc(OC)ccc3O)nc21
InChIInChI=1S/C15H18N4O2/c1-4-7-19-15-13(9(2)18-19)16-14(17-15)11-8-10(21-3)5-6-12(11)20/h5-6,8,20H,4,7H2,1-3H3,(H,16,17)
InChIKeyUYUMIXVHKQEQLC-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.86
Rot. Bonds4

About 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol

4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol (PubChem CID 135884196) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol.

Molecular Properties

Compound Name4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol
PubChem CID135884196
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol
SMILESCCCn1nc(C)c2[nH]c(-c3cc(OC)ccc3O)nc21
InChIInChI=1S/C15H18N4O2/c1-4-7-19-15-13(9(2)18-19)16-14(17-15)11-8-10(21-3)5-6-12(11)20/h5-6,8,20H,4,7H2,1-3H3,(H,16,17)
InChIKeyUYUMIXVHKQEQLC-UHFFFAOYSA-N
XLogP2.86
TPSA75.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-5-(3-methylphenyl)-1-propyl-4H-imidazo[4,5-d]pyrazole
CID 135906373
2-(6-bromo-4-methyl-1H-benzimidazol-2-yl)-4-methoxyphenol
CID 136727863
5-(2-hydroxy-5-methoxyphenyl)-2-methyl-1H-1,2,4-triazole-3-thione
CID 136674882
2-(1H-benzimidazol-2-yl)-4-methoxyphenol
CID 135463022
3-(4-methoxyphenyl)-1-propylpyrazol-5-amine
CID 61265330
4-methoxy-2-(1-methylimidazol-2-yl)phenol
CID 136869285
4-chloro-2-(6-methoxy-1H-benzimidazol-2-yl)phenol
CID 135905264
4-methoxy-2-[4-methyl-5-(methylamino)-1,2,4-triazol-3-yl]phenol
CID 136926758
4-amino-6-(2,5-dimethoxyphenyl)-2-propylpyridazin-3-one
CID 82467566
2-[[5-(2-hydroxy-5-methoxyphenyl)-2-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 136674887
4-methoxy-2-(2-methylpyrazol-3-yl)phenol
CID 136869284
7-(2-hydroxy-5-methoxyphenyl)-1-(2-methoxyethyl)pyrido[2,3-d]pyrimidine-2,4-dione
CID 154925291

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol?
The IUPAC name of 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol (CID 135884196) is 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol.
What is the SMILES notation for 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol?
The canonical SMILES for 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol is CCCn1nc(C)c2[nH]c(-c3cc(OC)ccc3O)nc21.
What is the InChIKey of 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol?
The InChIKey is UYUMIXVHKQEQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-4-7-19-15-13(9(2)18-19)16-14(17-15)11-8-10(21-3)5-6-12(11)20/h5-6,8,20H,4,7H2,1-3H3,(H,16,17).
What are the key properties of 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol?
4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol has a molecular weight of 286.33 g/mol, XLogP of 2.86, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(3-methyl-1-propyl-4H-imidazo[4,5-d]pyrazol-5-yl)phenol is sourced from PubChem (CID 135884196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).