4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide

C13H17N5O2 — CID 81240834

IUPAC4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide
SMILESCOCCn1cc(NC(=O)c2cnc(C)cc2N)cn1
InChIInChI=1S/C13H17N5O2/c1-9-5-12(14)11(7-15-9)13(19)17-10-6-16-18(8-10)3-4-20-2/h5-8H,3-4H2,1-2H3,(H2,14,15)(H,17,19)
InChIKeyLVHRPSAXAZWDID-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.07
Rot. Bonds5

About 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide

4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide (PubChem CID 81240834) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide
PubChem CID81240834
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide
SMILESCOCCn1cc(NC(=O)c2cnc(C)cc2N)cn1
InChIInChI=1S/C13H17N5O2/c1-9-5-12(14)11(7-15-9)13(19)17-10-6-16-18(8-10)3-4-20-2/h5-8H,3-4H2,1-2H3,(H2,14,15)(H,17,19)
InChIKeyLVHRPSAXAZWDID-UHFFFAOYSA-N
XLogP1.07
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-5-hydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 107074926
2-bromo-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 54878147
2-chloro-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-3-carboxamide
CID 61052437
2-(aminomethyl)-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-4-carboxamide
CID 114325867
5-hydrazinyl-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazine-2-carboxamide
CID 107377908
3-chloro-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-4-carboxamide
CID 66482554
(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
CID 119292252
2,6-dihydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 103749044
4-amino-6-methyl-N-phenylpyridine-3-carboxamide
CID 81236063
4-amino-N-(3,4-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
CID 81239196
4-chloro-6-methyl-N-[1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]pyridine-3-carboxamide
CID 81228976
N-[1-(2-methoxyethyl)pyrazol-4-yl]but-2-enamide
CID 78968035

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide (CID 81240834) is 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide is COCCn1cc(NC(=O)c2cnc(C)cc2N)cn1.
What is the InChIKey of 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide?
The InChIKey is LVHRPSAXAZWDID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-9-5-12(14)11(7-15-9)13(19)17-10-6-16-18(8-10)3-4-20-2/h5-8H,3-4H2,1-2H3,(H2,14,15)(H,17,19).
What are the key properties of 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide?
4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide has a molecular weight of 275.31 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81240834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).