N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide

C9H15NO2 — CID 12714147

IUPACN,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1CC(=O)C1(C)C
InChIInChI=1S/C9H15NO2/c1-9(2)6(5-7(9)11)8(12)10(3)4/h6H,5H2,1-4H3
InChIKeyHZKKYCRTBMPLBN-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.69
Rot. Bonds1

About N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide

N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide (PubChem CID 12714147) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide.

Molecular Properties

Compound NameN,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide
PubChem CID12714147
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC NameN,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1CC(=O)C1(C)C
InChIInChI=1S/C9H15NO2/c1-9(2)6(5-7(9)11)8(12)10(3)4/h6H,5H2,1-4H3
InChIKeyHZKKYCRTBMPLBN-UHFFFAOYSA-N
XLogP0.69
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,5,5-tetramethyl-4-oxohexanamide
CID 102472535
N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide
CID 12714149
N-methoxy-N,2,2-trimethyl-3-oxocyclobutane-1-carboxamide
CID 51357474
N-methoxy-N,1,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide
CID 51357752
1-N,1-N,2-N,2-N-tetramethylcyclobutane-1,2-dicarboxamide
CID 134893832
N,N,3,5,5-pentamethyl-4-oxohexanamide
CID 134973182
N,N,5-trimethyl-4-oxohexanamide
CID 20600835
trans-(1R,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide
CID 59461825
cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide
CID 59462396
N,N,2,3,3-pentamethyl-4-oxopentanamide
CID 59942395
2-Ethyl-N,N-dimethyl-4-oxopentanamide
CID 71373861
N,N,2,2,3,3-hexamethyl-4-oxopentanamide
CID 88267805

Frequently Asked Questions

What is the IUPAC name of N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide?
The IUPAC name of N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide (CID 12714147) is N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide.
What is the SMILES notation for N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide?
The canonical SMILES for N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide is CN(C)C(=O)C1CC(=O)C1(C)C.
What is the InChIKey of N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide?
The InChIKey is HZKKYCRTBMPLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-9(2)6(5-7(9)11)8(12)10(3)4/h6H,5H2,1-4H3.
What are the key properties of N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide?
N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide has a molecular weight of 169.22 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide is sourced from PubChem (CID 12714147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).