(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide

C10H20N2O2 — CID 130877690

IUPAC(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
SMILESC[C@H](O)CNC(=O)[C@H]1CCN[C@@H](C)C1
InChIInChI=1S/C10H20N2O2/c1-7-5-9(3-4-11-7)10(14)12-6-8(2)13/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-/m0/s1
InChIKeyNGAJLJBGTAOWTH-CIUDSAMLSA-N
MW200.28 g/mol
LogP-0.13
Rot. Bonds3

About (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide

(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide (PubChem CID 130877690) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
PubChem CID130877690
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
SMILESC[C@H](O)CNC(=O)[C@H]1CCN[C@@H](C)C1
InChIInChI=1S/C10H20N2O2/c1-7-5-9(3-4-11-7)10(14)12-6-8(2)13/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-/m0/s1
InChIKeyNGAJLJBGTAOWTH-CIUDSAMLSA-N
XLogP-0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S)-2-methyl-N-(2-methylsulfanylpropyl)piperidine-4-carboxamide;hydrochloride
CID 120639864
ethyl 2-methyl-3-[[(2S,4S)-2-methylpiperidine-4-carbonyl]amino]propanoate
CID 120633653
N-(2-hydroxyethyl)-2-methylpiperidine-4-carboxamide
CID 106738732
2-methyl-N-prop-2-ynylpiperidine-4-carboxamide
CID 106738666
N-(2-hydroxypropyl)cyclopropanecarboxamide
CID 43392750
2-hydroxy-4-[(2-methylpiperidine-4-carbonyl)amino]butanoic acid
CID 114006821
(2S,4S)-N-[[1-(1-hydroxy-2-methylpropyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120641285
N-(cyanomethyl)-2-methylpiperidine-4-carboxamide
CID 106739785
(2S,4S)-2-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-4-carboxamide
CID 120635200
(2S,4S)-N-(2-ethylhexyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120615953
(2S,4S)-N-(2-cyclopropylethyl)-2-methylpiperidine-4-carboxamide
CID 120633867
(2S,4S)-2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)piperidine-4-carboxamide;hydrochloride
CID 120632113

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide?
The IUPAC name of (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide (CID 130877690) is (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide.
What is the SMILES notation for (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide?
The canonical SMILES for (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide is C[C@H](O)CNC(=O)[C@H]1CCN[C@@H](C)C1.
What is the InChIKey of (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide?
The InChIKey is NGAJLJBGTAOWTH-CIUDSAMLSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7-5-9(3-4-11-7)10(14)12-6-8(2)13/h7-9,11,13H,3-6H2,1-2H3,(H,12,14)/t7-,8-,9-/m0/s1.
What are the key properties of (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide?
(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide has a molecular weight of 200.28 g/mol, XLogP of -0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide is sourced from PubChem (CID 130877690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).