2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid

C13H18N2O2 — CID 60731921

IUPAC2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NCCC1CCCC1
InChIInChI=1S/C13H18N2O2/c16-13(17)11-6-3-8-14-12(11)15-9-7-10-4-1-2-5-10/h3,6,8,10H,1-2,4-5,7,9H2,(H,14,15)(H,16,17)
InChIKeyGFZPJIADQCQEQM-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.77
Rot. Bonds5

About 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid

2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid (PubChem CID 60731921) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid
PubChem CID60731921
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NCCC1CCCC1
InChIInChI=1S/C13H18N2O2/c16-13(17)11-6-3-8-14-12(11)15-9-7-10-4-1-2-5-10/h3,6,8,10H,1-2,4-5,7,9H2,(H,14,15)(H,16,17)
InChIKeyGFZPJIADQCQEQM-UHFFFAOYSA-N
XLogP2.77
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-cyclopentylethylamino)-6-methylpyridine-3-carboxylic acid
CID 55223076
N-(2-cyclohexylethyl)-3-(trifluoromethyl)pyridin-2-amine
CID 63536770
2-(cycloheptylamino)pyridine-3-carboxylic acid
CID 43236673
2-[(2-methylcyclohexyl)methylamino]pyridine-3-carboxylic acid
CID 63511863
N-(2-cyclopentylethyl)-2-(methylamino)pyridine-3-carboxamide
CID 62180220
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62168476
2-(hexylamino)pyridine-3-carboxylic acid
CID 14222051
2-(3-phenylpropylamino)pyridine-3-carboxylic acid
CID 60654935
2-(cyclobutanecarbonylamino)pyridine-3-carboxylic acid
CID 63654626
2-[2-(methanesulfonamido)ethylamino]pyridine-3-carboxylic acid
CID 43420764
2-(3-butoxypropylamino)pyridine-3-carboxylic acid
CID 82341813
3-[2-(4-methylcyclohexyl)ethylamino]pyridazine-4-carboxylic acid
CID 80516830

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid?
The IUPAC name of 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid (CID 60731921) is 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid is O=C(O)c1cccnc1NCCC1CCCC1.
What is the InChIKey of 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid?
The InChIKey is GFZPJIADQCQEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c16-13(17)11-6-3-8-14-12(11)15-9-7-10-4-1-2-5-10/h3,6,8,10H,1-2,4-5,7,9H2,(H,14,15)(H,16,17).
What are the key properties of 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid?
2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid has a molecular weight of 234.30 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid is sourced from PubChem (CID 60731921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).