2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide

C14H20N2O3 — CID 31478295

IUPAC2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC[C@H](O)C1
InChIInChI=1S/C14H20N2O3/c1-19-13-7-3-2-6-12(13)15-14(18)10-16-8-4-5-11(17)9-16/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H,15,18)/t11-/m0/s1
InChIKeyHZMZLNGLAKVDFH-NSHDSACASA-N
MW264.32 g/mol
LogP1.09
Rot. Bonds4

About 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide

2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide (PubChem CID 31478295) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
PubChem CID31478295
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC[C@H](O)C1
InChIInChI=1S/C14H20N2O3/c1-19-13-7-3-2-6-12(13)15-14(18)10-16-8-4-5-11(17)9-16/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H,15,18)/t11-/m0/s1
InChIKeyHZMZLNGLAKVDFH-NSHDSACASA-N
XLogP1.09
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide (CID 31478295) is 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN1CCC[C@H](O)C1.
What is the InChIKey of 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The InChIKey is HZMZLNGLAKVDFH-NSHDSACASA-N. The full InChI is InChI=1S/C14H20N2O3/c1-19-13-7-3-2-6-12(13)15-14(18)10-16-8-4-5-11(17)9-16/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H,15,18)/t11-/m0/s1.
What are the key properties of 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 31478295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).