(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide

C9H18N2O2 — CID 130891391

IUPAC(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide
SMILESC[C@H]1NCCC[C@H]1C(=O)NCCO
InChIInChI=1S/C9H18N2O2/c1-7-8(3-2-4-10-7)9(13)11-5-6-12/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8-/m1/s1
InChIKeyNRPPWZHRHBVQAB-HTQZYQBOSA-N
MW186.25 g/mol
LogP-0.52
Rot. Bonds3

About (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide

(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide (PubChem CID 130891391) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide
PubChem CID130891391
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide
SMILESC[C@H]1NCCC[C@H]1C(=O)NCCO
InChIInChI=1S/C9H18N2O2/c1-7-8(3-2-4-10-7)9(13)11-5-6-12/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8-/m1/s1
InChIKeyNRPPWZHRHBVQAB-HTQZYQBOSA-N
XLogP-0.52
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-prop-2-ynylpiperidine-3-carboxamide
CID 131048074
N-but-2-ynyl-2-methylpiperidine-3-carboxamide
CID 127003919
N-[3-(methanesulfonamido)propyl]-2-methylpiperidine-3-carboxamide
CID 114175575
N-hydroxy-2-methylpiperidine-3-carboxamide
CID 130757003
2-methyl-N-(4-propan-2-yloxybutyl)piperidine-3-carboxamide
CID 114137522
N-(2-methoxy-2-methylpropyl)-2-methylpiperidine-3-carboxamide
CID 104761997
(2S,3S)-2-methyl-N-propan-2-ylpiperidine-3-carboxamide
CID 97050937
2-methyl-N-pent-3-ynylpyrrolidine-3-carboxamide
CID 116644086
N-[2-(dimethylamino)ethyl]-2-methylpyrrolidine-3-carboxamide
CID 79383065
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide
CID 105418341
N-[2-(2-methoxyphenyl)ethyl]-2-methylpiperidine-3-carboxamide
CID 106261503
2-[(2-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 79388783

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide?
The IUPAC name of (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide (CID 130891391) is (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide?
The canonical SMILES for (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide is C[C@H]1NCCC[C@H]1C(=O)NCCO.
What is the InChIKey of (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide?
The InChIKey is NRPPWZHRHBVQAB-HTQZYQBOSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7-8(3-2-4-10-7)9(13)11-5-6-12/h7-8,10,12H,2-6H2,1H3,(H,11,13)/t7-,8-/m1/s1.
What are the key properties of (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide?
(2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide has a molecular weight of 186.25 g/mol, XLogP of -0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-(2-hydroxyethyl)-2-methylpiperidine-3-carboxamide is sourced from PubChem (CID 130891391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).