2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid

C14H20N2O4 — CID 120518663

IUPAC2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
SMILESCC(C)Oc1cccc(C(=O)N(C)C(C)(C)C(=O)O)n1
InChIInChI=1S/C14H20N2O4/c1-9(2)20-11-8-6-7-10(15-11)12(17)16(5)14(3,4)13(18)19/h6-9H,1-5H3,(H,18,19)
InChIKeyYCSWBUGEPQQUHN-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.80
Rot. Bonds5

About 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid

2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid (PubChem CID 120518663) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid.

Molecular Properties

Compound Name2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
PubChem CID120518663
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
SMILESCC(C)Oc1cccc(C(=O)N(C)C(C)(C)C(=O)O)n1
InChIInChI=1S/C14H20N2O4/c1-9(2)20-11-8-6-7-10(15-11)12(17)16(5)14(3,4)13(18)19/h6-9H,1-5H3,(H,18,19)
InChIKeyYCSWBUGEPQQUHN-UHFFFAOYSA-N
XLogP1.80
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-[methyl-[6-(2,2,2-trifluoroethoxy)pyridine-2-carbonyl]amino]propanoic acid
CID 120518819
2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
CID 120520363
2-methyl-2-[methyl-(6-propan-2-yloxypyridine-3-carbonyl)amino]propanoic acid
CID 119200444
3-[ethyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
CID 120516584
(6-propan-2-yloxy-2-pyridinyl) hydrogen carbonate
CID 129216307
3-[(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid
CID 120515163
N-(2-hydroxypropyl)-6-propan-2-yloxypyridine-2-carboxamide
CID 109399314
3-methyl-2-[(6-propan-2-yloxypyridine-2-carbonyl)amino]pentanoic acid
CID 120520770
2-methyl-2-[methyl-(2-phenyl-1,3-thiazole-4-carbonyl)amino]propanoic acid
CID 119200022
4-propan-2-yloxy-3-[(6-propan-2-yloxypyridine-2-carbonyl)amino]benzoic acid
CID 120517846
N-[(1S,5R,6R)-7,7-dimethyl-2-oxabicyclo[3.2.0]heptan-6-yl]-N-methyl-6-propan-2-yloxypyridine-2-carboxamide
CID 97242334
2-[(4-aminoquinoline-2-carbonyl)-methylamino]-2-methylpropanoic acid
CID 115485636

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid?
The IUPAC name of 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid (CID 120518663) is 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid.
What is the SMILES notation for 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid?
The canonical SMILES for 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid is CC(C)Oc1cccc(C(=O)N(C)C(C)(C)C(=O)O)n1.
What is the InChIKey of 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid?
The InChIKey is YCSWBUGEPQQUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-9(2)20-11-8-6-7-10(15-11)12(17)16(5)14(3,4)13(18)19/h6-9H,1-5H3,(H,18,19).
What are the key properties of 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid?
2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid has a molecular weight of 280.32 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[methyl-(6-propan-2-yloxypyridine-2-carbonyl)amino]propanoic acid is sourced from PubChem (CID 120518663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).