4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide

C10H12N4O2 — CID 11846458

IUPAC4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide
SMILESCCOc1nc(C(=O)NC)cc(N)c1C#N
InChIInChI=1S/C10H12N4O2/c1-3-16-10-6(5-11)7(12)4-8(14-10)9(15)13-2/h4H,3H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyZJEWMDXOXBQHAB-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.29
Rot. Bonds3

About 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide

4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide (PubChem CID 11846458) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide
PubChem CID11846458
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide
SMILESCCOc1nc(C(=O)NC)cc(N)c1C#N
InChIInChI=1S/C10H12N4O2/c1-3-16-10-6(5-11)7(12)4-8(14-10)9(15)13-2/h4H,3H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyZJEWMDXOXBQHAB-UHFFFAOYSA-N
XLogP0.29
TPSA101.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide (CID 11846458) is 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide is CCOc1nc(C(=O)NC)cc(N)c1C#N.
What is the InChIKey of 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide?
The InChIKey is ZJEWMDXOXBQHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-3-16-10-6(5-11)7(12)4-8(14-10)9(15)13-2/h4H,3H2,1-2H3,(H2,12,14)(H,13,15).
What are the key properties of 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide?
4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide has a molecular weight of 220.23 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyano-6-ethoxy-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 11846458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).