2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid

C14H20N2O3 — CID 63834345

IUPAC2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid
SMILESCc1ccc(C(=O)O)c(NCCOC2CCCC2)n1
InChIInChI=1S/C14H20N2O3/c1-10-6-7-12(14(17)18)13(16-10)15-8-9-19-11-4-2-3-5-11/h6-7,11H,2-5,8-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyUZPDMXSESVOPJN-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.46
Rot. Bonds6

About 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid

2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid (PubChem CID 63834345) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid
PubChem CID63834345
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid
SMILESCc1ccc(C(=O)O)c(NCCOC2CCCC2)n1
InChIInChI=1S/C14H20N2O3/c1-10-6-7-12(14(17)18)13(16-10)15-8-9-19-11-4-2-3-5-11/h6-7,11H,2-5,8-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyUZPDMXSESVOPJN-UHFFFAOYSA-N
XLogP2.46
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-chloro-2-(2-cyclopentyloxyethylamino)pyridine-3-carboxylic acid
CID 63827444
2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carbothioamide
CID 63828659
2-(2-cyclopentylethylamino)-6-methylpyridine-3-carboxylic acid
CID 55223076
2-[2-(4-aminocyclohexyl)oxyethylamino]-6-methylpyridine-3-carboxamide
CID 63871182
2-[2-(2-methoxyethoxy)ethylamino]-6-methylpyridine-3-carboxylic acid
CID 55107366
2-(2-cyclopentyloxyethylamino)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
CID 63833983
N-(2-cyclopentyloxyethyl)-6-methyl-3-nitropyridin-2-amine
CID 81138260
2-(2-cyclohexyloxyethylamino)-4-methylpyrimidine-5-carboxylic acid
CID 83181617
4-(2-cyclopentyloxyethylamino)-2,3-difluorobenzoic acid
CID 79840391
6-methyl-2-(pent-3-ynylamino)pyridine-3-carboxylic acid
CID 116645397
2-[(3-hydroxycyclopentyl)methylamino]-6-methylpyridine-3-carboxylic acid
CID 106137549
methyl 4-(2-cyclohexyloxyethylamino)-6-methylpyrimidine-2-carboxylate
CID 66285067

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid?
The IUPAC name of 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid (CID 63834345) is 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid?
The canonical SMILES for 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid is Cc1ccc(C(=O)O)c(NCCOC2CCCC2)n1.
What is the InChIKey of 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid?
The InChIKey is UZPDMXSESVOPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-6-7-12(14(17)18)13(16-10)15-8-9-19-11-4-2-3-5-11/h6-7,11H,2-5,8-9H2,1H3,(H,15,16)(H,17,18).
What are the key properties of 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid?
2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid has a molecular weight of 264.32 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentyloxyethylamino)-6-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 63834345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).