5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine

C11H13N3O — CID 6456680

IUPAC5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine
SMILESCOCc1[nH]nc(N)c1-c1ccccc1
InChIInChI=1S/C11H13N3O/c1-15-7-9-10(11(12)14-13-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H3,12,13,14)
InChIKeyREIKKMUTPQYVNL-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.81
Rot. Bonds3

About 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine

5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine (PubChem CID 6456680) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine
PubChem CID6456680
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine
SMILESCOCc1[nH]nc(N)c1-c1ccccc1
InChIInChI=1S/C11H13N3O/c1-15-7-9-10(11(12)14-13-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H3,12,13,14)
InChIKeyREIKKMUTPQYVNL-UHFFFAOYSA-N
XLogP1.81
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-Chlorophenyl)-5-(methoxymethyl)-1H-pyrazol-3-amine
CID 16653083
Butanamide, N,N-dibutyl-4-((1-oxobutyl)amino)-
CID 3068047
4-(2-Methoxyphenyl)-5-methyl-1H-pyrazol-3-amine
CID 16653075
4-(3-methoxyphenyl)-5-methyl-1H-pyrazol-3-amine
CID 30033142
(4-methyl-3-phenyl-1H-pyrazol-5-yl)methanol
CID 54847426
4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-amine
CID 867922
3-(methoxymethyl)-4-(4-methoxyphenyl)-1H-pyrazol-5-amine
CID 6501942
4-(4-chlorophenyl)-3-(methoxymethyl)-1H-pyrazol-5-amine hydrochloride
CID 43810771
4-(3-fluoro-4-methoxyphenyl)-5-methyl-1H-pyrazol-3-amine
CID 82079969
5-(3-Methoxy-phenyl)-4-methyl-2H-pyrazol-3-ylamine
CID 6484151
4-Phenyl-1H-pyrazole-3,5-dimethanol
CID 3616748
4-(4-ethylphenyl)-5-(methoxymethyl)-3-methyl-1H-pyrazole
CID 121498919

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine?
The IUPAC name of 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine (CID 6456680) is 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine is COCc1[nH]nc(N)c1-c1ccccc1.
What is the InChIKey of 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine?
The InChIKey is REIKKMUTPQYVNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-15-7-9-10(11(12)14-13-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H3,12,13,14).
What are the key properties of 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine?
5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine has a molecular weight of 203.25 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-4-phenyl-1H-pyrazol-3-amine is sourced from PubChem (CID 6456680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).