N-ethenyl-1-methylazetidine-3-carboxamide

C7H12N2O — CID 156647641

IUPACN-ethenyl-1-methylazetidine-3-carboxamide
SMILESC=CNC(=O)C1CN(C)C1
InChIInChI=1S/C7H12N2O/c1-3-8-7(10)6-4-9(2)5-6/h3,6H,1,4-5H2,2H3,(H,8,10)
InChIKeyPQXKXDJPCWCIBE-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.19
Rot. Bonds2

About N-ethenyl-1-methylazetidine-3-carboxamide

N-ethenyl-1-methylazetidine-3-carboxamide (PubChem CID 156647641) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is N-ethenyl-1-methylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-ethenyl-1-methylazetidine-3-carboxamide
PubChem CID156647641
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC NameN-ethenyl-1-methylazetidine-3-carboxamide
SMILESC=CNC(=O)C1CN(C)C1
InChIInChI=1S/C7H12N2O/c1-3-8-7(10)6-4-9(2)5-6/h3,6H,1,4-5H2,2H3,(H,8,10)
InChIKeyPQXKXDJPCWCIBE-UHFFFAOYSA-N
XLogP-0.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-1-methylazetidine-3-carboxamide?
The IUPAC name of N-ethenyl-1-methylazetidine-3-carboxamide (CID 156647641) is N-ethenyl-1-methylazetidine-3-carboxamide.
What is the SMILES notation for N-ethenyl-1-methylazetidine-3-carboxamide?
The canonical SMILES for N-ethenyl-1-methylazetidine-3-carboxamide is C=CNC(=O)C1CN(C)C1.
What is the InChIKey of N-ethenyl-1-methylazetidine-3-carboxamide?
The InChIKey is PQXKXDJPCWCIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-3-8-7(10)6-4-9(2)5-6/h3,6H,1,4-5H2,2H3,(H,8,10).
What are the key properties of N-ethenyl-1-methylazetidine-3-carboxamide?
N-ethenyl-1-methylazetidine-3-carboxamide has a molecular weight of 140.19 g/mol, XLogP of -0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-1-methylazetidine-3-carboxamide is sourced from PubChem (CID 156647641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).