1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide

C14H19N5O2 — CID 64781700

IUPAC1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide
SMILESCNC(=O)c1ccn(-c2ccc(N)c(OCC(C)C)n2)n1
InChIInChI=1S/C14H19N5O2/c1-9(2)8-21-14-10(15)4-5-12(17-14)19-7-6-11(18-19)13(20)16-3/h4-7,9H,8,15H2,1-3H3,(H,16,20)
InChIKeyQZBKZYOPNKVLIM-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.24
Rot. Bonds5

About 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide

1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide (PubChem CID 64781700) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide
PubChem CID64781700
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide
SMILESCNC(=O)c1ccn(-c2ccc(N)c(OCC(C)C)n2)n1
InChIInChI=1S/C14H19N5O2/c1-9(2)8-21-14-10(15)4-5-12(17-14)19-7-6-11(18-19)13(20)16-3/h4-7,9H,8,15H2,1-3H3,(H,16,20)
InChIKeyQZBKZYOPNKVLIM-UHFFFAOYSA-N
XLogP1.24
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide?
The IUPAC name of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide (CID 64781700) is 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide.
What is the SMILES notation for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide?
The canonical SMILES for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide is CNC(=O)c1ccn(-c2ccc(N)c(OCC(C)C)n2)n1.
What is the InChIKey of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide?
The InChIKey is QZBKZYOPNKVLIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-9(2)8-21-14-10(15)4-5-12(17-14)19-7-6-11(18-19)13(20)16-3/h4-7,9H,8,15H2,1-3H3,(H,16,20).
What are the key properties of 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide?
1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide has a molecular weight of 289.34 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-amino-6-(2-methylpropoxy)-2-pyridinyl]-N-methylpyrazole-3-carboxamide is sourced from PubChem (CID 64781700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).