cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide

C11H19NO2 — CID 59462396

IUPACcis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide
SMILESCC(C)C(=O)[C@@H]1CC[C@@H]1C(=O)N(C)C
InChIInChI=1S/C11H19NO2/c1-7(2)10(13)8-5-6-9(8)11(14)12(3)4/h7-9H,5-6H2,1-4H3/t8-,9+/m1/s1
InChIKeyFVYZRFPAFSOREN-BDAKNGLRSA-N
MW197.28 g/mol
LogP1.33
Rot. Bonds3

About cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide

cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide (PubChem CID 59462396) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide
PubChem CID59462396
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Namecis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide
SMILESCC(C)C(=O)[C@@H]1CC[C@@H]1C(=O)N(C)C
InChIInChI=1S/C11H19NO2/c1-7(2)10(13)8-5-6-9(8)11(14)12(3)4/h7-9H,5-6H2,1-4H3/t8-,9+/m1/s1
InChIKeyFVYZRFPAFSOREN-BDAKNGLRSA-N
XLogP1.33
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-2-(2-oxocyclopentyl)acetamide
CID 71299227
N,N,2,2-tetramethyl-3-oxocyclobutane-1-carboxamide
CID 12714147
N,N,1,2,2-pentamethyl-3-oxocyclobutane-1-carboxamide
CID 12714149
4-cyclohexyl-N,N-dimethyl-4-oxobutanamide
CID 138966505
N,N,3,7-tetramethyl-5-oxooctanamide
CID 14507550
4-(cyclobutanecarbonyl)-N,N-dimethyl-3,5-dioxocyclohexane-1-carboxamide
CID 21276344
3-cyclobutyl-N,N-dimethyl-2-oxopropanamide
CID 22977910
4-acetyl-N,N-dimethylcyclohexane-1-carboxamide
CID 57537415
9-ethyl-N,N-dimethyl-6-oxododecanamide
CID 58332884
N,N-dimethyl-3-(4-oxocyclohexyl)pentanamide
CID 58562824
3-cyclobutyl-N,N,2-trimethylpropanamide
CID 59113006
N,N-dimethyl-2-(4-oxocyclohexyl)acetamide
CID 59442836

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide?
The IUPAC name of cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide (CID 59462396) is cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide.
What is the SMILES notation for cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide?
The canonical SMILES for cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide is CC(C)C(=O)[C@@H]1CC[C@@H]1C(=O)N(C)C.
What is the InChIKey of cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide?
The InChIKey is FVYZRFPAFSOREN-BDAKNGLRSA-N. The full InChI is InChI=1S/C11H19NO2/c1-7(2)10(13)8-5-6-9(8)11(14)12(3)4/h7-9H,5-6H2,1-4H3/t8-,9+/m1/s1.
What are the key properties of cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide?
cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-N,N-dimethyl-2-(2-methylpropanoyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 59462396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).