1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine

C10H15N5S — CID 66010744

IUPAC1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1Sc1nccn1C
InChIInChI=1S/C10H15N5S/c1-4-15-9(8(11)7(2)13-15)16-10-12-5-6-14(10)3/h5-6H,4,11H2,1-3H3
InChIKeyPHZODRHJDLGNTQ-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.68
Rot. Bonds3

About 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine

1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine (PubChem CID 66010744) has the molecular formula C10H15N5S and a molecular weight of 237.33 g/mol. Its IUPAC name is 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine
PubChem CID66010744
Molecular FormulaC10H15N5S
Molecular Weight237.33 g/mol
Exact Mass237.10
IUPAC Name1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1Sc1nccn1C
InChIInChI=1S/C10H15N5S/c1-4-15-9(8(11)7(2)13-15)16-10-12-5-6-14(10)3/h5-6H,4,11H2,1-3H3
InChIKeyPHZODRHJDLGNTQ-UHFFFAOYSA-N
XLogP1.68
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine?
The IUPAC name of 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine (CID 66010744) is 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine is CCn1nc(C)c(N)c1Sc1nccn1C.
What is the InChIKey of 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine?
The InChIKey is PHZODRHJDLGNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5S/c1-4-15-9(8(11)7(2)13-15)16-10-12-5-6-14(10)3/h5-6H,4,11H2,1-3H3.
What are the key properties of 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine?
1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine has a molecular weight of 237.33 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-5-(1-methylimidazol-2-yl)sulfanylpyrazol-4-amine is sourced from PubChem (CID 66010744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).