1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine

C12H16N4 — CID 62294313

IUPAC1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1-n1cccn1
InChIInChI=1S/C12H16N4/c1-9-7-10(2)15-12(11(9)8-13-3)16-6-4-5-14-16/h4-7,13H,8H2,1-3H3
InChIKeyOPSKSBSWJZYZQH-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.60
Rot. Bonds3

About 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine

1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine (PubChem CID 62294313) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine
PubChem CID62294313
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1-n1cccn1
InChIInChI=1S/C12H16N4/c1-9-7-10(2)15-12(11(9)8-13-3)16-6-4-5-14-16/h4-7,13H,8H2,1-3H3
InChIKeyOPSKSBSWJZYZQH-UHFFFAOYSA-N
XLogP1.60
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 ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine (CID 62294313) is 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine is CNCc1c(C)cc(C)nc1-n1cccn1.
What is the InChIKey of 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine?
The InChIKey is OPSKSBSWJZYZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-7-10(2)15-12(11(9)8-13-3)16-6-4-5-14-16/h4-7,13H,8H2,1-3H3.
What are the key properties of 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine?
1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine has a molecular weight of 216.29 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-2-pyrazol-1-yl-3-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 62294313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).