(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide

C15H24N2O2S — CID 97335931

IUPAC(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide
SMILESO=C(NCCCc1cccs1)N1CCCC[C@@H]1CCO
InChIInChI=1S/C15H24N2O2S/c18-11-8-13-5-1-2-10-17(13)15(19)16-9-3-6-14-7-4-12-20-14/h4,7,12-13,18H,1-3,5-6,8-11H2,(H,16,19)/t13-/m1/s1
InChIKeyNQWLVXBZFPEMAO-CYBMUJFWSA-N
MW296.44 g/mol
LogP2.63
Rot. Bonds6

About (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide

(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide (PubChem CID 97335931) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide
PubChem CID97335931
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide
SMILESO=C(NCCCc1cccs1)N1CCCC[C@@H]1CCO
InChIInChI=1S/C15H24N2O2S/c18-11-8-13-5-1-2-10-17(13)15(19)16-9-3-6-14-7-4-12-20-14/h4,7,12-13,18H,1-3,5-6,8-11H2,(H,16,19)/t13-/m1/s1
InChIKeyNQWLVXBZFPEMAO-CYBMUJFWSA-N
XLogP2.63
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 126435167
(2S)-N-[3-(2-fluorophenyl)propyl]-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 125140406
(2R)-N-(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 126427962
N-(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 118766404
(2S)-2-(2-hydroxyethyl)-N-[2-(4-methylphenyl)ethyl]piperidine-1-carboxamide
CID 124670162
morpholin-4-yl-[(2S)-2-(2-thiophen-2-ylethyl)piperidin-1-yl]methanone
CID 95708561
1-[2-(bromomethyl)azepan-1-yl]-4-thiophen-2-ylbutan-1-one
CID 116639623
2-(2-hydroxyethyl)-N-[2-(3-methoxyphenyl)ethyl]piperidine-1-carboxamide
CID 108901080
2-[2-(hydroxymethyl)azepan-1-yl]-N-(2-thiophen-2-ylethyl)acetamide
CID 116637722
2-[[2-(2-hydroxyethyl)piperidine-1-carbonyl]amino]acetic acid
CID 43445645
(2R)-2-(hydroxymethyl)-N-[(2R)-2-methyl-3-thiophen-2-ylpropyl]pyrrolidine-1-carboxamide
CID 95967500
morpholin-4-yl-[4-[2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]phenyl]methanone
CID 131910259

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The IUPAC name of (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide (CID 97335931) is (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide is O=C(NCCCc1cccs1)N1CCCC[C@@H]1CCO.
What is the InChIKey of (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide?
The InChIKey is NQWLVXBZFPEMAO-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H24N2O2S/c18-11-8-13-5-1-2-10-17(13)15(19)16-9-3-6-14-7-4-12-20-14/h4,7,12-13,18H,1-3,5-6,8-11H2,(H,16,19)/t13-/m1/s1.
What are the key properties of (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide?
(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide has a molecular weight of 296.44 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide is sourced from PubChem (CID 97335931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).