N-methylmethanamine;2H-oxazine

C6H12N2O — CID 175165731

IUPACN-methylmethanamine;2H-oxazine
SMILESC1=CNOC=C1.CNC
InChIInChI=1S/C4H5NO.C2H7N/c1-2-4-6-5-3-1;1-3-2/h1-5H;3H,1-2H3
InChIKeyYOHJZHPMSFSVCW-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.38
Rot. Bonds

About N-methylmethanamine;2H-oxazine

N-methylmethanamine;2H-oxazine (PubChem CID 175165731) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is N-methylmethanamine;2H-oxazine.

Molecular Properties

Compound NameN-methylmethanamine;2H-oxazine
PubChem CID175165731
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC NameN-methylmethanamine;2H-oxazine
SMILESC1=CNOC=C1.CNC
InChIInChI=1S/C4H5NO.C2H7N/c1-2-4-6-5-3-1;1-3-2/h1-5H;3H,1-2H3
InChIKeyYOHJZHPMSFSVCW-UHFFFAOYSA-N
XLogP0.38
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;2H-oxazine?
The IUPAC name of N-methylmethanamine;2H-oxazine (CID 175165731) is N-methylmethanamine;2H-oxazine.
What is the SMILES notation for N-methylmethanamine;2H-oxazine?
The canonical SMILES for N-methylmethanamine;2H-oxazine is C1=CNOC=C1.CNC.
What is the InChIKey of N-methylmethanamine;2H-oxazine?
The InChIKey is YOHJZHPMSFSVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO.C2H7N/c1-2-4-6-5-3-1;1-3-2/h1-5H;3H,1-2H3.
What are the key properties of N-methylmethanamine;2H-oxazine?
N-methylmethanamine;2H-oxazine has a molecular weight of 128.17 g/mol, XLogP of 0.38, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;2H-oxazine is sourced from PubChem (CID 175165731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).