(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide

C10H13ClN2O2 — CID 170444222

IUPAC(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide
SMILESCC[C@@H](Oc1ncc(C)cc1Cl)C(N)=O
InChIInChI=1S/C10H13ClN2O2/c1-3-8(9(12)14)15-10-7(11)4-6(2)5-13-10/h4-5,8H,3H2,1-2H3,(H2,12,14)/t8-/m1/s1
InChIKeyVXWVWKFNZCEVQA-MRVPVSSYSA-N
MW228.68 g/mol
LogP1.69
Rot. Bonds4

About (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide

(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide (PubChem CID 170444222) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide.

Molecular Properties

Compound Name(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide
PubChem CID170444222
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide
SMILESCC[C@@H](Oc1ncc(C)cc1Cl)C(N)=O
InChIInChI=1S/C10H13ClN2O2/c1-3-8(9(12)14)15-10-7(11)4-6(2)5-13-10/h4-5,8H,3H2,1-2H3,(H2,12,14)/t8-/m1/s1
InChIKeyVXWVWKFNZCEVQA-MRVPVSSYSA-N
XLogP1.69
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide?
The IUPAC name of (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide (CID 170444222) is (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide.
What is the SMILES notation for (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide?
The canonical SMILES for (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide is CC[C@@H](Oc1ncc(C)cc1Cl)C(N)=O.
What is the InChIKey of (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide?
The InChIKey is VXWVWKFNZCEVQA-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-3-8(9(12)14)15-10-7(11)4-6(2)5-13-10/h4-5,8H,3H2,1-2H3,(H2,12,14)/t8-/m1/s1.
What are the key properties of (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide?
(2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide has a molecular weight of 228.68 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3-chloro-5-methyl-2-pyridinyl)oxy]butanamide is sourced from PubChem (CID 170444222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).