2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

C13H16N4O2 — CID 103028916

IUPAC2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCOC(C)(C)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C13H16N4O2/c1-13(2,19-3)12(18)16-10-6-4-7-14-11(10)17-9-5-8-15-17/h4-9H,1-3H3,(H,16,18)
InChIKeySZTZKHDONMTYIU-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.63
Rot. Bonds4

About 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (PubChem CID 103028916) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
PubChem CID103028916
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCOC(C)(C)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C13H16N4O2/c1-13(2,19-3)12(18)16-10-6-4-7-14-11(10)17-9-5-8-15-17/h4-9H,1-3H3,(H,16,18)
InChIKeySZTZKHDONMTYIU-UHFFFAOYSA-N
XLogP1.63
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (CID 103028916) is 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is COC(C)(C)C(=O)Nc1cccnc1-n1cccn1.
What is the InChIKey of 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The InChIKey is SZTZKHDONMTYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-13(2,19-3)12(18)16-10-6-4-7-14-11(10)17-9-5-8-15-17/h4-9H,1-3H3,(H,16,18).
What are the key properties of 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide has a molecular weight of 260.30 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 103028916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).