1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine

C12H16N4 — CID 105098559

IUPAC1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)c1cc(C)nn1C
InChIInChI=1S/C12H16N4/c1-9-7-11(16(3)15-9)12(13-2)10-5-4-6-14-8-10/h4-8,12-13H,1-3H3
InChIKeyOVDORBFHPZIKQO-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.43
Rot. Bonds3

About 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine

1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine (PubChem CID 105098559) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine
PubChem CID105098559
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)c1cc(C)nn1C
InChIInChI=1S/C12H16N4/c1-9-7-11(16(3)15-9)12(13-2)10-5-4-6-14-8-10/h4-8,12-13H,1-3H3
InChIKeyOVDORBFHPZIKQO-UHFFFAOYSA-N
XLogP1.43
TPSA42.74 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 ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethylpyrazol-3-yl)-1-(3-fluoro-4-pyridinyl)-N-methylmethanamine
CID 105182032
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(3-propylphenyl)methanamine
CID 105187988
N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine
CID 115374295
N-methyl-1-(1-methylindazol-3-yl)-1-pyridin-3-ylmethanamine
CID 103126250
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 105149645
[pyridin-3-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
CID 105287039
N-methyl-1-pyridin-3-yl-1-pyrimidin-4-ylmethanamine
CID 63988330
1-(4-chloro-1-methylpyrazol-5-yl)-1-(2,5-dimethylpyrazol-3-yl)-N-methylmethanamine
CID 105186116
1-(1-benzofuran-2-yl)-1-(2,5-dimethylpyrazol-3-yl)-N-methylmethanamine
CID 105184868
(1R)-1-(4-fluorophenyl)-N-methyl-1-pyridin-3-ylmethanamine
CID 51693922
(2,5-dimethylpyrazol-3-yl)-phenylmethanol
CID 105076375
1-(1-benzothiophen-7-yl)-1-(2,5-dimethylpyrazol-3-yl)-N-methylmethanamine
CID 105172867

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine (CID 105098559) is 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine is CNC(c1cccnc1)c1cc(C)nn1C.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The InChIKey is OVDORBFHPZIKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-7-11(16(3)15-9)12(13-2)10-5-4-6-14-8-10/h4-8,12-13H,1-3H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine?
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine has a molecular weight of 216.29 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 105098559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).