(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide

C11H22N2OS — CID 103811787

IUPAC(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide
SMILESCCSCC(C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C11H22N2OS/c1-3-15-8-9(2)13-11(14)10-6-4-5-7-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1
InChIKeyPZDGEHYGRUQQGP-QVDQXJPCSA-N
MW230.38 g/mol
LogP1.39
Rot. Bonds5

About (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide

(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide (PubChem CID 103811787) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide
PubChem CID103811787
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC Name(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide
SMILESCCSCC(C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C11H22N2OS/c1-3-15-8-9(2)13-11(14)10-6-4-5-7-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1
InChIKeyPZDGEHYGRUQQGP-QVDQXJPCSA-N
XLogP1.39
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(1-methylsulfanylpropan-2-yl)piperidine-2-carboxamide
CID 103812007
(2S)-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119330672
N-(5-methylhexan-2-yl)piperidine-2-carboxamide
CID 43579330
(2S)-N-(4-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 104914608
(2R)-N-(4-methylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119789194
N-(4-methylsulfanylbutan-2-yl)azocane-2-carboxamide
CID 114240218
N-[1-(diethylamino)propan-2-yl]piperidine-2-carboxamide;dihydrochloride
CID 119860546
methyl 3-[[(2R)-piperidine-2-carbonyl]amino]butanoate;hydrochloride
CID 119695157
methyl 3-(piperidine-2-carbonylamino)butanoate;hydrochloride
CID 119274282
N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119330827
N-(1-methylsulfonylpropan-2-yl)azepane-2-carboxamide
CID 64643195
N-(3-methylpentan-2-yl)azepane-2-carboxamide
CID 64564622

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide?
The IUPAC name of (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide (CID 103811787) is (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide is CCSCC(C)NC(=O)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide?
The InChIKey is PZDGEHYGRUQQGP-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H22N2OS/c1-3-15-8-9(2)13-11(14)10-6-4-5-7-12-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1.
What are the key properties of (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide?
(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide has a molecular weight of 230.38 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide is sourced from PubChem (CID 103811787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).