1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine

C15H25N5 — CID 103014921

IUPAC1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine
SMILESCCNC(C)c1c(C)nn(CCc2cnn(C)c2)c1C
InChIInChI=1S/C15H25N5/c1-6-16-11(2)15-12(3)18-20(13(15)4)8-7-14-9-17-19(5)10-14/h9-11,16H,6-8H2,1-5H3
InChIKeyDFMRUAOFPKZLQL-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.15
Rot. Bonds6

About 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine

1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine (PubChem CID 103014921) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine.

Molecular Properties

Compound Name1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine
PubChem CID103014921
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine
SMILESCCNC(C)c1c(C)nn(CCc2cnn(C)c2)c1C
InChIInChI=1S/C15H25N5/c1-6-16-11(2)15-12(3)18-20(13(15)4)8-7-14-9-17-19(5)10-14/h9-11,16H,6-8H2,1-5H3
InChIKeyDFMRUAOFPKZLQL-UHFFFAOYSA-N
XLogP2.15
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-1-[1-[(1-ethylpyrazol-4-yl)methyl]-3,5-dimethylpyrazol-4-yl]ethanamine
CID 62730637
1-[1-(2-ethoxyethyl)-3,5-dimethylpyrazol-4-yl]-N-ethylethanamine
CID 62730461
N-ethyl-1-[1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]ethanamine
CID 62732271
1-[1-(2-butoxyethyl)-3,5-dimethylpyrazol-4-yl]-N-ethylethanamine
CID 62731733
1-[3,5-dimethyl-1-(2-propylsulfonylethyl)pyrazol-4-yl]-N-ethylethanamine
CID 106730522
N-[2-(1-methylpyrazol-4-yl)ethyl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 80682119
N-ethyl-3-(1-methylpyrazol-4-yl)-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
CID 103030288
N-ethyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43492401
1-N,1-N,3-N-triethyl-5-(1-methylpyrazol-4-yl)pentane-1,3-diamine
CID 103011204
1-methyl-4-propylpyrazole;propane
CID 155742221
1-[1-[(2,5-difluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-N-ethylethanamine
CID 62731555
N-[1-[3,5-dimethyl-1-[(1-methyltriazol-4-yl)methyl]pyrazol-4-yl]ethyl]propan-1-amine
CID 107053678

Frequently Asked Questions

What is the IUPAC name of 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine?
The IUPAC name of 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine (CID 103014921) is 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine.
What is the SMILES notation for 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine?
The canonical SMILES for 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine is CCNC(C)c1c(C)nn(CCc2cnn(C)c2)c1C.
What is the InChIKey of 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine?
The InChIKey is DFMRUAOFPKZLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-6-16-11(2)15-12(3)18-20(13(15)4)8-7-14-9-17-19(5)10-14/h9-11,16H,6-8H2,1-5H3.
What are the key properties of 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine?
1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine has a molecular weight of 275.40 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,5-dimethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-yl]-N-ethylethanamine is sourced from PubChem (CID 103014921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).