2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid

C14H20N2O3 — CID 43570535

IUPAC2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid
SMILESCc1nc(C(=O)N(C)C(C)C(C)C)ccc1C(=O)O
InChIInChI=1S/C14H20N2O3/c1-8(2)10(4)16(5)13(17)12-7-6-11(14(18)19)9(3)15-12/h6-8,10H,1-5H3,(H,18,19)
InChIKeyYULKLBNLFPUWLX-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.20
Rot. Bonds4

About 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid

2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid (PubChem CID 43570535) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid
PubChem CID43570535
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid
SMILESCc1nc(C(=O)N(C)C(C)C(C)C)ccc1C(=O)O
InChIInChI=1S/C14H20N2O3/c1-8(2)10(4)16(5)13(17)12-7-6-11(14(18)19)9(3)15-12/h6-8,10H,1-5H3,(H,18,19)
InChIKeyYULKLBNLFPUWLX-UHFFFAOYSA-N
XLogP2.20
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid?
The IUPAC name of 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid (CID 43570535) is 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid?
The canonical SMILES for 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid is Cc1nc(C(=O)N(C)C(C)C(C)C)ccc1C(=O)O.
What is the InChIKey of 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid?
The InChIKey is YULKLBNLFPUWLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-8(2)10(4)16(5)13(17)12-7-6-11(14(18)19)9(3)15-12/h6-8,10H,1-5H3,(H,18,19).
What are the key properties of 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid?
2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid has a molecular weight of 264.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[methyl(3-methylbutan-2-yl)carbamoyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 43570535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).