2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine

C12H16N4 — CID 114877993

IUPAC2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(N)Cc1cnn(C)c1
InChIInChI=1S/C12H16N4/c1-9-3-4-14-7-11(9)12(13)5-10-6-15-16(2)8-10/h3-4,6-8,12H,5,13H2,1-2H3
InChIKeyFTPYBASBAJDOLZ-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.37
Rot. Bonds3

About 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine

2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine (PubChem CID 114877993) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine
PubChem CID114877993
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine
SMILESCc1ccncc1C(N)Cc1cnn(C)c1
InChIInChI=1S/C12H16N4/c1-9-3-4-14-7-11(9)12(13)5-10-6-15-16(2)8-10/h3-4,6-8,12H,5,13H2,1-2H3
InChIKeyFTPYBASBAJDOLZ-UHFFFAOYSA-N
XLogP1.37
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 114878627
1-(1,5-dimethylpyrazol-4-yl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 105114026
2-(1-methylpyrazol-4-yl)-1-pyrimidin-4-ylethanamine
CID 63989977
[2-(1-methylpyrazol-4-yl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261883
2-(1-methylpyrazol-4-yl)-1-pyrazin-2-ylethanamine
CID 62125921
1-(4-methylphenyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 62125918
1-(2-iodophenyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 115821792
2-(1-methylpyrazol-4-yl)-1-quinolin-4-ylethanamine
CID 105114119
2-(1-methylpyrazol-4-yl)-1-pyrimidin-5-ylethanamine
CID 102923318
1-(2,4-difluorophenyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 63086432
1-(2,5-dibromophenyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 115822012
1-(1-methylpyrazol-4-yl)-2-pyridin-4-ylethanamine
CID 62551755

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine (CID 114877993) is 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine is Cc1ccncc1C(N)Cc1cnn(C)c1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine?
The InChIKey is FTPYBASBAJDOLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-3-4-14-7-11(9)12(13)5-10-6-15-16(2)8-10/h3-4,6-8,12H,5,13H2,1-2H3.
What are the key properties of 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine?
2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine has a molecular weight of 216.29 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)-1-(4-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 114877993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).