(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide

C11H22N2O2 — CID 136581733

IUPAC(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide
SMILESC[C@@H](O)CNC(=O)[C@H]1CCN(C)[C@@H](C)C1
InChIInChI=1S/C11H22N2O2/c1-8-6-10(4-5-13(8)3)11(15)12-7-9(2)14/h8-10,14H,4-7H2,1-3H3,(H,12,15)/t8-,9+,10-/m0/s1
InChIKeyQWAKDXHBDXTDAW-AEJSXWLSSA-N
MW214.31 g/mol
LogP0.21
Rot. Bonds3

About (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide

(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide (PubChem CID 136581733) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide
PubChem CID136581733
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide
SMILESC[C@@H](O)CNC(=O)[C@H]1CCN(C)[C@@H](C)C1
InChIInChI=1S/C11H22N2O2/c1-8-6-10(4-5-13(8)3)11(15)12-7-9(2)14/h8-10,14H,4-7H2,1-3H3,(H,12,15)/t8-,9+,10-/m0/s1
InChIKeyQWAKDXHBDXTDAW-AEJSXWLSSA-N
XLogP0.21
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(2-hydroxypropyl)piperidine-4-carboxamide
CID 43392752
N-(2-hydroxypropyl)cyclopropanecarboxamide
CID 43392750
N-(2-hydroxypropyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 43418235
(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
CID 130877690
(2R)-1-[(1,2-dimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906841
N-[(2R)-2-hydroxypropyl]-2-methylcyclopropane-1-carboxamide
CID 83032173
3-N-[(2S)-2-hydroxypropyl]piperidine-1,3-dicarboxamide
CID 83059648
N-[(2S)-2-hydroxypropyl]piperidin-1-ium-4-carboxamide
CID 7172187
N-[(2S)-2-hydroxypropyl]-5-methyloxolane-3-carboxamide
CID 104979236
N-[(2R)-2-hydroxypropyl]-1-methylsulfonylpiperidine-3-carboxamide
CID 83031962
N-[(2R)-2-hydroxypropyl]oxolane-3-carboxamide
CID 83032356
4-tert-butyl-N-[(2S)-2-hydroxypropyl]cyclohexane-1-carboxamide
CID 83030657

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide?
The IUPAC name of (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide (CID 136581733) is (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide?
The canonical SMILES for (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide is C[C@@H](O)CNC(=O)[C@H]1CCN(C)[C@@H](C)C1.
What is the InChIKey of (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide?
The InChIKey is QWAKDXHBDXTDAW-AEJSXWLSSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8-6-10(4-5-13(8)3)11(15)12-7-9(2)14/h8-10,14H,4-7H2,1-3H3,(H,12,15)/t8-,9+,10-/m0/s1.
What are the key properties of (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide?
(2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-N-[(2R)-2-hydroxypropyl]-1,2-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 136581733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).