3-ethyl-N-methylazetidine-1-carboxamide

C7H14N2O — CID 67128899

IUPAC3-ethyl-N-methylazetidine-1-carboxamide
SMILESCCC1CN(C(=O)NC)C1
InChIInChI=1S/C7H14N2O/c1-3-6-4-9(5-6)7(10)8-2/h6H,3-5H2,1-2H3,(H,8,10)
InChIKeyOMRUKPMGHNIRJI-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.67
Rot. Bonds1

About 3-ethyl-N-methylazetidine-1-carboxamide

3-ethyl-N-methylazetidine-1-carboxamide (PubChem CID 67128899) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-ethyl-N-methylazetidine-1-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-methylazetidine-1-carboxamide
PubChem CID67128899
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name3-ethyl-N-methylazetidine-1-carboxamide
SMILESCCC1CN(C(=O)NC)C1
InChIInChI=1S/C7H14N2O/c1-3-6-4-9(5-6)7(10)8-2/h6H,3-5H2,1-2H3,(H,8,10)
InChIKeyOMRUKPMGHNIRJI-UHFFFAOYSA-N
XLogP0.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-Methylbutyl)urea
CID 69407
3-Ethyl-3-methylazetidine-1-carboxamide
CID 128466913
2-Methylbutylurea
CID 22179633
3-fluoro-N-methylazetidine-1-carboxamide
CID 131086353
2-fluoro-N-methylazetidine-1-carboxamide
CID 141334052
N-methyl-3-(trifluoromethyl)azetidine-1-carboxamide
CID 175983808
1,1-Dimethyl-3-(3-methylbutyl)urea
CID 19801237
N-methyl-3-(2,2,2-trifluoroethyl)azetidine-1-carboxamide
CID 126988272
N-ethyl-3-fluoro-3-methylazetidine-1-carboxamide
CID 127000099
3-fluoro-N,3-dimethylazetidine-1-carboxamide
CID 131089872
3-(2,2-difluoroethyl)-N-ethylazetidine-1-carboxamide
CID 132299974
3-(1-fluoroethyl)-N-[(2R)-3-methylbutan-2-yl]azetidine-1-carboxamide
CID 165064974

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methylazetidine-1-carboxamide?
The IUPAC name of 3-ethyl-N-methylazetidine-1-carboxamide (CID 67128899) is 3-ethyl-N-methylazetidine-1-carboxamide.
What is the SMILES notation for 3-ethyl-N-methylazetidine-1-carboxamide?
The canonical SMILES for 3-ethyl-N-methylazetidine-1-carboxamide is CCC1CN(C(=O)NC)C1.
What is the InChIKey of 3-ethyl-N-methylazetidine-1-carboxamide?
The InChIKey is OMRUKPMGHNIRJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-6-4-9(5-6)7(10)8-2/h6H,3-5H2,1-2H3,(H,8,10).
What are the key properties of 3-ethyl-N-methylazetidine-1-carboxamide?
3-ethyl-N-methylazetidine-1-carboxamide has a molecular weight of 142.20 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methylazetidine-1-carboxamide is sourced from PubChem (CID 67128899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).