1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide

C11H12N4O2 — CID 170565992

IUPAC1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide
SMILESCn1nc(COc2ccccn2)cc1C(N)=O
InChIInChI=1S/C11H12N4O2/c1-15-9(11(12)16)6-8(14-15)7-17-10-4-2-3-5-13-10/h2-6H,7H2,1H3,(H2,12,16)
InChIKeyRRYDLCOBSXUVAH-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.49
Rot. Bonds4

About 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide

1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide (PubChem CID 170565992) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide
PubChem CID170565992
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide
SMILESCn1nc(COc2ccccn2)cc1C(N)=O
InChIInChI=1S/C11H12N4O2/c1-15-9(11(12)16)6-8(14-15)7-17-10-4-2-3-5-13-10/h2-6H,7H2,1H3,(H2,12,16)
InChIKeyRRYDLCOBSXUVAH-UHFFFAOYSA-N
XLogP0.49
TPSA83.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-3-(2,2,2-trifluoroethyl)pyrazole-5-carboxamide
CID 177051073
6-(pyridin-2-ylmethoxy)pyridine-3-carboxamide
CID 12017600
2-methyl-5-(pyridin-2-ylmethoxy)indazole-3-carboxamide
CID 170419321
1-methyl-3-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-5-carboxylic acid
CID 117215965
12-pyridin-2-yloxydodecyl acetate
CID 70684250
N,N-dimethyl-4-(pyridin-2-yloxymethyl)benzamide
CID 75402934
3-ethyl-1-methyl-N-phenylmethoxypyrazole-5-carboxamide
CID 66120747
1-methyl-3-[(5-methyl-3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazole-5-carboxylic acid
CID 66643856
2,5-dimethylpyrazole-3-carboxamide;hydrochloride
CID 68886245
(4-pyridin-2-yloxyphenyl) 5-carbamoyl-1-methylpyrrole-3-sulfonate
CID 55565435
methyl 2-pyridin-2-yloxyacetate
CID 45091085
4-(pyridin-2-yloxymethyl)benzoic acid
CID 21105508

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide?
The IUPAC name of 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide (CID 170565992) is 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide.
What is the SMILES notation for 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide?
The canonical SMILES for 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide is Cn1nc(COc2ccccn2)cc1C(N)=O.
What is the InChIKey of 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide?
The InChIKey is RRYDLCOBSXUVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-15-9(11(12)16)6-8(14-15)7-17-10-4-2-3-5-13-10/h2-6H,7H2,1H3,(H2,12,16).
What are the key properties of 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide?
1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(pyridin-2-yloxymethyl)pyrazole-5-carboxamide is sourced from PubChem (CID 170565992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).