(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide

C14H20N2O3 — CID 129492775

IUPAC(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide
SMILESCC(C)[C@H]1OCCC[C@H]1C(=O)Nc1ncccc1O
InChIInChI=1S/C14H20N2O3/c1-9(2)12-10(5-4-8-19-12)14(18)16-13-11(17)6-3-7-15-13/h3,6-7,9-10,12,17H,4-5,8H2,1-2H3,(H,15,16,18)/t10-,12-/m1/s1
InChIKeyULHPHDCHHULCGC-ZYHUDNBSSA-N
MW264.32 g/mol
LogP2.18
Rot. Bonds3

About (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide

(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide (PubChem CID 129492775) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide
PubChem CID129492775
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide
SMILESCC(C)[C@H]1OCCC[C@H]1C(=O)Nc1ncccc1O
InChIInChI=1S/C14H20N2O3/c1-9(2)12-10(5-4-8-19-12)14(18)16-13-11(17)6-3-7-15-13/h3,6-7,9-10,12,17H,4-5,8H2,1-2H3,(H,15,16,18)/t10-,12-/m1/s1
InChIKeyULHPHDCHHULCGC-ZYHUDNBSSA-N
XLogP2.18
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide?
The IUPAC name of (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide (CID 129492775) is (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide?
The canonical SMILES for (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide is CC(C)[C@H]1OCCC[C@H]1C(=O)Nc1ncccc1O.
What is the InChIKey of (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide?
The InChIKey is ULHPHDCHHULCGC-ZYHUDNBSSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9(2)12-10(5-4-8-19-12)14(18)16-13-11(17)6-3-7-15-13/h3,6-7,9-10,12,17H,4-5,8H2,1-2H3,(H,15,16,18)/t10-,12-/m1/s1.
What are the key properties of (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide?
(2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-(3-hydroxy-2-pyridinyl)-2-propan-2-yloxane-3-carboxamide is sourced from PubChem (CID 129492775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).