5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid

C12H16N2O2 — CID 115490773

IUPAC5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid
SMILESCN(c1ccc(C(=O)O)nc1)C1CCCC1
InChIInChI=1S/C12H16N2O2/c1-14(9-4-2-3-5-9)10-6-7-11(12(15)16)13-8-10/h6-9H,2-5H2,1H3,(H,15,16)
InChIKeyZVSCRAAHGQWVPA-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.16
Rot. Bonds3

About 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid

5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid (PubChem CID 115490773) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid
PubChem CID115490773
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid
SMILESCN(c1ccc(C(=O)O)nc1)C1CCCC1
InChIInChI=1S/C12H16N2O2/c1-14(9-4-2-3-5-9)10-6-7-11(12(15)16)13-8-10/h6-9H,2-5H2,1H3,(H,15,16)
InChIKeyZVSCRAAHGQWVPA-UHFFFAOYSA-N
XLogP2.16
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-hydroxycyclohexyl)-methylamino]pyridine-2-carboxylic acid
CID 102632504
5-[methyl-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]amino]pyridine-2-carboxylic acid
CID 175563782
5-[cyclopentyl(methyl)amino]-N'-hydroxypyridine-2-carboximidamide
CID 136967271
1-[5-[cyclopentyl(methyl)amino]-2-pyridinyl]ethanol
CID 83131595
5-[methyl(3-methylbutanoyl)amino]pyridine-2-carboxylic acid
CID 115268096
5-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carboxylic acid
CID 115490992
5-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]pyridine-2-carboxylic acid
CID 105418652
2-amino-N-[5-[cyclohexyl(methyl)amino]-2-pyridinyl]propanamide
CID 82034836
1-[5-[cycloheptyl(methyl)amino]-2-pyridinyl]propan-1-ol
CID 112585300
6-[cyclopentyl(methyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558469
3-[cycloheptyl(methyl)amino]benzoic acid
CID 102822720
N-cyclohexyl-6-hydrazinyl-N-methylpyridin-3-amine
CID 82055075

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid (CID 115490773) is 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid is CN(c1ccc(C(=O)O)nc1)C1CCCC1.
What is the InChIKey of 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid?
The InChIKey is ZVSCRAAHGQWVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-14(9-4-2-3-5-9)10-6-7-11(12(15)16)13-8-10/h6-9H,2-5H2,1H3,(H,15,16).
What are the key properties of 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid?
5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid has a molecular weight of 220.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopentyl(methyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 115490773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).