2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid

C15H20N2O4 — CID 129468796

IUPAC2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid
SMILESCC(C)Oc1cccc(C(=O)N2CCC[C@@H]2CC(=O)O)n1
InChIInChI=1S/C15H20N2O4/c1-10(2)21-13-7-3-6-12(16-13)15(20)17-8-4-5-11(17)9-14(18)19/h3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,18,19)/t11-/m1/s1
InChIKeyPREHFJWEOIXDGM-LLVKDONJSA-N
MW292.34 g/mol
LogP1.95
Rot. Bonds5

About 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid

2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid (PubChem CID 129468796) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid
PubChem CID129468796
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid
SMILESCC(C)Oc1cccc(C(=O)N2CCC[C@@H]2CC(=O)O)n1
InChIInChI=1S/C15H20N2O4/c1-10(2)21-13-7-3-6-12(16-13)15(20)17-8-4-5-11(17)9-14(18)19/h3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,18,19)/t11-/m1/s1
InChIKeyPREHFJWEOIXDGM-LLVKDONJSA-N
XLogP1.95
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid?
The IUPAC name of 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid (CID 129468796) is 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid.
What is the SMILES notation for 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid?
The canonical SMILES for 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid is CC(C)Oc1cccc(C(=O)N2CCC[C@@H]2CC(=O)O)n1.
What is the InChIKey of 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid?
The InChIKey is PREHFJWEOIXDGM-LLVKDONJSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-10(2)21-13-7-3-6-12(16-13)15(20)17-8-4-5-11(17)9-14(18)19/h3,6-7,10-11H,4-5,8-9H2,1-2H3,(H,18,19)/t11-/m1/s1.
What are the key properties of 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid?
2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid has a molecular weight of 292.34 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-(6-propan-2-yloxypyridine-2-carbonyl)pyrrolidin-2-yl]acetic acid is sourced from PubChem (CID 129468796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).