N,N-dimethylazetidine-3-carboxamide;hydrochloride

C6H13ClN2O — CID 53308702

IUPACN,N-dimethylazetidine-3-carboxamide;hydrochloride
SMILESCN(C)C(=O)C1CNC1.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8(2)6(9)5-3-7-4-5;/h5,7H,3-4H2,1-2H3;1H
InChIKeyRVANNEBQEVYYQL-UHFFFAOYSA-N
MW164.64 g/mol
LogP-0.28
Rot. Bonds1

About N,N-dimethylazetidine-3-carboxamide;hydrochloride

N,N-dimethylazetidine-3-carboxamide;hydrochloride (PubChem CID 53308702) has the molecular formula C6H13ClN2O and a molecular weight of 164.64 g/mol. Its IUPAC name is N,N-dimethylazetidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN,N-dimethylazetidine-3-carboxamide;hydrochloride
PubChem CID53308702
Molecular FormulaC6H13ClN2O
Molecular Weight164.64 g/mol
Exact Mass164.07
IUPAC NameN,N-dimethylazetidine-3-carboxamide;hydrochloride
SMILESCN(C)C(=O)C1CNC1.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8(2)6(9)5-3-7-4-5;/h5,7H,3-4H2,1-2H3;1H
InChIKeyRVANNEBQEVYYQL-UHFFFAOYSA-N
XLogP-0.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.64
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylazetidine-3-carboxamide;hydrochloride?
The IUPAC name of N,N-dimethylazetidine-3-carboxamide;hydrochloride (CID 53308702) is N,N-dimethylazetidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N,N-dimethylazetidine-3-carboxamide;hydrochloride?
The canonical SMILES for N,N-dimethylazetidine-3-carboxamide;hydrochloride is CN(C)C(=O)C1CNC1.Cl.
What is the InChIKey of N,N-dimethylazetidine-3-carboxamide;hydrochloride?
The InChIKey is RVANNEBQEVYYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.ClH/c1-8(2)6(9)5-3-7-4-5;/h5,7H,3-4H2,1-2H3;1H.
What are the key properties of N,N-dimethylazetidine-3-carboxamide;hydrochloride?
N,N-dimethylazetidine-3-carboxamide;hydrochloride has a molecular weight of 164.64 g/mol, XLogP of -0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylazetidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 53308702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).