5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine

C15H19N5O — CID 79498563

IUPAC5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(N2C(N)=NCC2c2c(C)n[nH]c2C)cc1
InChIInChI=1S/C15H19N5O/c1-9-14(10(2)19-18-9)13-8-17-15(16)20(13)11-4-6-12(21-3)7-5-11/h4-7,13H,8H2,1-3H3,(H2,16,17)(H,18,19)
InChIKeyBKLGSARSFQXXTC-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.91
Rot. Bonds3

About 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine

5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79498563) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79498563
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(N2C(N)=NCC2c2c(C)n[nH]c2C)cc1
InChIInChI=1S/C15H19N5O/c1-9-14(10(2)19-18-9)13-8-17-15(16)20(13)11-4-6-12(21-3)7-5-11/h4-7,13H,8H2,1-3H3,(H2,16,17)(H,18,19)
InChIKeyBKLGSARSFQXXTC-UHFFFAOYSA-N
XLogP1.91
TPSA79.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine (CID 79498563) is 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine is COc1ccc(N2C(N)=NCC2c2c(C)n[nH]c2C)cc1.
What is the InChIKey of 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is BKLGSARSFQXXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-9-14(10(2)19-18-9)13-8-17-15(16)20(13)11-4-6-12(21-3)7-5-11/h4-7,13H,8H2,1-3H3,(H2,16,17)(H,18,19).
What are the key properties of 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine?
5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 285.35 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79498563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).