5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine

C10H14ClN5 — CID 66012487

IUPAC5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1-n1cc(Cl)c(C)n1
InChIInChI=1S/C10H14ClN5/c1-4-15-10(9(12)7(3)14-15)16-5-8(11)6(2)13-16/h5H,4,12H2,1-3H3
InChIKeyPJODZBPLUPNNSE-UHFFFAOYSA-N
MW239.71 g/mol
LogP1.94
Rot. Bonds2

About 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine

5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine (PubChem CID 66012487) has the molecular formula C10H14ClN5 and a molecular weight of 239.71 g/mol. Its IUPAC name is 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine.

Molecular Properties

Compound Name5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine
PubChem CID66012487
Molecular FormulaC10H14ClN5
Molecular Weight239.71 g/mol
Exact Mass239.09
IUPAC Name5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1-n1cc(Cl)c(C)n1
InChIInChI=1S/C10H14ClN5/c1-4-15-10(9(12)7(3)14-15)16-5-8(11)6(2)13-16/h5H,4,12H2,1-3H3
InChIKeyPJODZBPLUPNNSE-UHFFFAOYSA-N
XLogP1.94
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-3-methyl-5-[4-(trifluoromethyl)pyrazol-1-yl]pyrazol-4-amine
CID 66012292
5-(3-cyclopropylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine
CID 66011902
1-ethyl-3-methyl-5-(3,4,5-trimethylpyrazol-1-yl)pyrazol-4-amine
CID 66011317
1-ethyl-3-methyl-5-piperidin-1-ylpyrazol-4-amine
CID 66012579
5-(2,2-dimethylpyrrolidin-1-yl)-1-ethyl-3-methylpyrazol-4-amine
CID 66011690
2-(4-chloro-3-methylpyrazol-1-yl)-6-methylaniline
CID 86676843
5-(2-chlorophenoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66012101
(4-amino-1-ethyl-3-methylpyrazol-5-yl)-(2-chlorophenyl)methanone
CID 154148009
5-(2,5-dichlorophenoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66011123
1-(4-amino-1-ethyl-3-methylpyrazol-5-yl)-3,3-dimethylpiperidin-4-ol
CID 112747122
5-(2,5-dichlorophenyl)sulfanyl-1-ethyl-3-methylpyrazol-4-amine
CID 66010943
1-ethyl-3-methyl-5-propylpyrazol-4-amine
CID 130537699

Frequently Asked Questions

What is the IUPAC name of 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine?
The IUPAC name of 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine (CID 66012487) is 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine.
What is the SMILES notation for 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine?
The canonical SMILES for 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine is CCn1nc(C)c(N)c1-n1cc(Cl)c(C)n1.
What is the InChIKey of 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine?
The InChIKey is PJODZBPLUPNNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN5/c1-4-15-10(9(12)7(3)14-15)16-5-8(11)6(2)13-16/h5H,4,12H2,1-3H3.
What are the key properties of 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine?
5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine has a molecular weight of 239.71 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chloro-3-methylpyrazol-1-yl)-1-ethyl-3-methylpyrazol-4-amine is sourced from PubChem (CID 66012487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).