N,1-dimethylazetidin-3-amine

C5H12N2 — CID 22174643

IUPACN,1-dimethylazetidin-3-amine
SMILESCNC1CN(C)C1
InChIInChI=1S/C5H12N2/c1-6-5-3-7(2)4-5/h5-6H,3-4H2,1-2H3
InChIKeyYCNHOXDFQLCQEU-UHFFFAOYSA-N
MW100.17 g/mol
LogP-0.48
Rot. Bonds1

About N,1-dimethylazetidin-3-amine

N,1-dimethylazetidin-3-amine (PubChem CID 22174643) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is N,1-dimethylazetidin-3-amine.

Molecular Properties

Compound NameN,1-dimethylazetidin-3-amine
PubChem CID22174643
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC NameN,1-dimethylazetidin-3-amine
SMILESCNC1CN(C)C1
InChIInChI=1S/C5H12N2/c1-6-5-3-7(2)4-5/h5-6H,3-4H2,1-2H3
InChIKeyYCNHOXDFQLCQEU-UHFFFAOYSA-N
XLogP-0.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethylazetidin-3-amine?
The IUPAC name of N,1-dimethylazetidin-3-amine (CID 22174643) is N,1-dimethylazetidin-3-amine.
What is the SMILES notation for N,1-dimethylazetidin-3-amine?
The canonical SMILES for N,1-dimethylazetidin-3-amine is CNC1CN(C)C1.
What is the InChIKey of N,1-dimethylazetidin-3-amine?
The InChIKey is YCNHOXDFQLCQEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-6-5-3-7(2)4-5/h5-6H,3-4H2,1-2H3.
What are the key properties of N,1-dimethylazetidin-3-amine?
N,1-dimethylazetidin-3-amine has a molecular weight of 100.17 g/mol, XLogP of -0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethylazetidin-3-amine is sourced from PubChem (CID 22174643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).