1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine

C10H11FN4 — CID 105390553

IUPAC1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine
SMILESCNCc1ccnc(-n2cccn2)c1F
InChIInChI=1S/C10H11FN4/c1-12-7-8-3-5-13-10(9(8)11)15-6-2-4-14-15/h2-6,12H,7H2,1H3
InChIKeyLQHMGGXAFIKOHK-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.13
Rot. Bonds3

About 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine

1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine (PubChem CID 105390553) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine
PubChem CID105390553
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine
SMILESCNCc1ccnc(-n2cccn2)c1F
InChIInChI=1S/C10H11FN4/c1-12-7-8-3-5-13-10(9(8)11)15-6-2-4-14-15/h2-6,12H,7H2,1H3
InChIKeyLQHMGGXAFIKOHK-UHFFFAOYSA-N
XLogP1.13
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine (CID 105390553) is 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine is CNCc1ccnc(-n2cccn2)c1F.
What is the InChIKey of 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine?
The InChIKey is LQHMGGXAFIKOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c1-12-7-8-3-5-13-10(9(8)11)15-6-2-4-14-15/h2-6,12H,7H2,1H3.
What are the key properties of 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine?
1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine has a molecular weight of 206.22 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-pyrazol-1-yl-4-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 105390553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).