5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid

C16H24N2O3 — CID 114408588

IUPAC5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid
SMILESCC1CCC(C(C)C)C(Oc2nc(C(=O)O)ccc2N)C1
InChIInChI=1S/C16H24N2O3/c1-9(2)11-5-4-10(3)8-14(11)21-15-12(17)6-7-13(18-15)16(19)20/h6-7,9-11,14H,4-5,8,17H2,1-3H3,(H,19,20)
InChIKeySRFKGLWRIIWIHD-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.20
Rot. Bonds4

About 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid

5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid (PubChem CID 114408588) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid
PubChem CID114408588
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid
SMILESCC1CCC(C(C)C)C(Oc2nc(C(=O)O)ccc2N)C1
InChIInChI=1S/C16H24N2O3/c1-9(2)11-5-4-10(3)8-14(11)21-15-12(17)6-7-13(18-15)16(19)20/h6-7,9-11,14H,4-5,8,17H2,1-3H3,(H,19,20)
InChIKeySRFKGLWRIIWIHD-UHFFFAOYSA-N
XLogP3.20
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2,3-diamine
CID 79827219
2,5-dimethyl-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyrimidin-4-amine
CID 80860237
4-bromo-2-(5-methyl-2-propan-2-ylcyclohexyl)oxyaniline
CID 65342644
5-bromo-2-(5-methyl-2-propan-2-ylcyclohexyl)oxybenzoic acid
CID 114896117
5-amino-6-(cyclopropylmethoxy)pyridine-2-carboxylic acid
CID 114408700
bis[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-methylpropanedioate
CID 101364051
5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide
CID 114408551
2-hydroxy-2-[4-(5-methyl-2-propan-2-ylcyclohexyl)oxyphenyl]acetic acid
CID 166450076
(5-methyl-2-propan-2-ylcyclohexyl) 2-aminobenzoate
CID 8633
(5-methyl-2-propan-2-ylcyclohexyl) 3-aminopyridine-2-carboxylate
CID 104743106
(5-methyl-2-propan-2-ylcyclohexyl) 2-amino-5-[[4-amino-3-(5-methyl-2-propan-2-ylcyclohexyl)oxycarbonylphenyl]diselanyl]benzoate
CID 170519195
6-chloro-2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-3-nitropyridine
CID 43330212

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid (CID 114408588) is 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid is CC1CCC(C(C)C)C(Oc2nc(C(=O)O)ccc2N)C1.
What is the InChIKey of 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid?
The InChIKey is SRFKGLWRIIWIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-9(2)11-5-4-10(3)8-14(11)21-15-12(17)6-7-13(18-15)16(19)20/h6-7,9-11,14H,4-5,8,17H2,1-3H3,(H,19,20).
What are the key properties of 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid?
5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid has a molecular weight of 292.38 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(5-methyl-2-propan-2-ylcyclohexyl)oxypyridine-2-carboxylic acid is sourced from PubChem (CID 114408588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).