N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide

C9H18N2O — CID 59032904

IUPACN-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1C[C@@H](C)N[C@@H](C)C1
InChIInChI=1S/C9H18N2O/c1-6-4-9(11-8(3)12)5-7(2)10-6/h6-7,9-10H,4-5H2,1-3H3,(H,11,12)/t6-,7+,9?
InChIKeyCVWTWUPHYGKGRK-AVSFMBPQSA-N
MW170.26 g/mol
LogP0.65
Rot. Bonds1

About N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide

N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide (PubChem CID 59032904) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
PubChem CID59032904
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1C[C@@H](C)N[C@@H](C)C1
InChIInChI=1S/C9H18N2O/c1-6-4-9(11-8(3)12)5-7(2)10-6/h6-7,9-10H,4-5H2,1-3H3,(H,11,12)/t6-,7+,9?
InChIKeyCVWTWUPHYGKGRK-AVSFMBPQSA-N
XLogP0.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,6-dimethylcycloheptyl)acetamide
CID 89468976
N-(3-iodocyclobutyl)acetamide
CID 145126673
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
N-(6-hydroxy-8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 14126987
N-[(3S)-3-methylcyclohexyl]acetamide
CID 143244343
N-[(5R)-6-methyl-3-bicyclo[3.2.0]heptanyl]acetamide
CID 166848885
N-[(1R,3S)-3-(methylamino)cyclopentyl]acetamide
CID 139574017
N-(3-propan-2-ylcyclobutyl)acetamide
CID 59410589
(2S,4S)-2,4-dimethylazetidine;hydrochloride
CID 135392273
ethane;N-(3-methylcyclohexyl)acetamide
CID 156753874
(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid
CID 178194513
N-(5-acetamido-3,3-dimethylcyclohexyl)acetamide
CID 23292846

Frequently Asked Questions

What is the IUPAC name of N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide?
The IUPAC name of N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide (CID 59032904) is N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide.
What is the SMILES notation for N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide?
The canonical SMILES for N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide is CC(=O)NC1C[C@@H](C)N[C@@H](C)C1.
What is the InChIKey of N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide?
The InChIKey is CVWTWUPHYGKGRK-AVSFMBPQSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-4-9(11-8(3)12)5-7(2)10-6/h6-7,9-10H,4-5H2,1-3H3,(H,11,12)/t6-,7+,9?.
What are the key properties of N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide?
N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.65, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide is sourced from PubChem (CID 59032904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).