3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid

C14H18N2O4 — CID 61380391

IUPAC3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid
SMILESCC(Oc1cccnc1C(=O)O)C(=O)NC1CCCC1
InChIInChI=1S/C14H18N2O4/c1-9(13(17)16-10-5-2-3-6-10)20-11-7-4-8-15-12(11)14(18)19/h4,7-10H,2-3,5-6H2,1H3,(H,16,17)(H,18,19)
InChIKeyGOWQHKYXZIVFMR-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.61
Rot. Bonds5

About 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid

3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid (PubChem CID 61380391) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid
PubChem CID61380391
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid
SMILESCC(Oc1cccnc1C(=O)O)C(=O)NC1CCCC1
InChIInChI=1S/C14H18N2O4/c1-9(13(17)16-10-5-2-3-6-10)20-11-7-4-8-15-12(11)14(18)19/h4,7-10H,2-3,5-6H2,1H3,(H,16,17)(H,18,19)
InChIKeyGOWQHKYXZIVFMR-UHFFFAOYSA-N
XLogP1.61
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 43083117
(2R)-2-(2-acetamidophenoxy)-N-cyclohexylpropanamide
CID 9111099
(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
N-cyclopentyl-2-[2-(2-hydroxyethyl)phenoxy]propanamide
CID 107713127
2-(3-amino-2-methylphenoxy)-N-cyclopentylpropanamide
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CID 60651700

Frequently Asked Questions

What is the IUPAC name of 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid?
The IUPAC name of 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid (CID 61380391) is 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid.
What is the SMILES notation for 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid?
The canonical SMILES for 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid is CC(Oc1cccnc1C(=O)O)C(=O)NC1CCCC1.
What is the InChIKey of 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid?
The InChIKey is GOWQHKYXZIVFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-9(13(17)16-10-5-2-3-6-10)20-11-7-4-8-15-12(11)14(18)19/h4,7-10H,2-3,5-6H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid?
3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid has a molecular weight of 278.31 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxypyridine-2-carboxylic acid is sourced from PubChem (CID 61380391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).