N-methyl-1-(3-methyloxetan-2-yl)methanamine

C6H13NO — CID 123426765

IUPACN-methyl-1-(3-methyloxetan-2-yl)methanamine
SMILESCNCC1OCC1C
InChIInChI=1S/C6H13NO/c1-5-4-8-6(5)3-7-2/h5-7H,3-4H2,1-2H3
InChIKeyQBLWDLIDHGQLCR-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.24
Rot. Bonds2

About N-methyl-1-(3-methyloxetan-2-yl)methanamine

N-methyl-1-(3-methyloxetan-2-yl)methanamine (PubChem CID 123426765) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is N-methyl-1-(3-methyloxetan-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methyloxetan-2-yl)methanamine
PubChem CID123426765
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC NameN-methyl-1-(3-methyloxetan-2-yl)methanamine
SMILESCNCC1OCC1C
InChIInChI=1S/C6H13NO/c1-5-4-8-6(5)3-7-2/h5-7H,3-4H2,1-2H3
InChIKeyQBLWDLIDHGQLCR-UHFFFAOYSA-N
XLogP0.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(3-methyloxetan-2-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;N-methyl-1-(5-methyloxolan-3-yl)methanamine
CID 143946958
1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine
CID 129125937
3-methyl-2-pentyloxetane
CID 20557182
(2S,3S)-2-[(2-aminoethylamino)methyl]-4-methyloxolan-3-ol
CID 58527557
5-[2-[3,4-dihydroxy-5-(2-hydroxypropan-2-yl)oxan-2-yl]oxypropan-2-yl]-2-(methylaminomethyl)oxane-3,4-diol
CID 170116233
[(3R,4R)-3,4,5-trimethyloxan-2-yl]methanol
CID 58400213
(2R,3S,4S,5R)-2-(hydroxymethyl)-4-methoxy-5-methyloxan-3-ol
CID 58017669
(2R,3R)-4-methyl-3-propan-2-yloxy-2-(propan-2-yloxymethyl)oxolane
CID 159866983
2-(hydroxymethyl)-4-methoxy-5-methyloxan-3-ol
CID 19699685
(2S,3S)-2,3-dimethyloxetane
CID 76764483
(2R,3R,4R,5S)-2-(hydroxymethyl)-5-methyloxane-3,4-diol
CID 142842456
6-(hydroxymethyl)-5-methyloxan-3-ol
CID 123248394

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methyloxetan-2-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methyloxetan-2-yl)methanamine (CID 123426765) is N-methyl-1-(3-methyloxetan-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methyloxetan-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methyloxetan-2-yl)methanamine is CNCC1OCC1C.
What is the InChIKey of N-methyl-1-(3-methyloxetan-2-yl)methanamine?
The InChIKey is QBLWDLIDHGQLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-5-4-8-6(5)3-7-2/h5-7H,3-4H2,1-2H3.
What are the key properties of N-methyl-1-(3-methyloxetan-2-yl)methanamine?
N-methyl-1-(3-methyloxetan-2-yl)methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methyloxetan-2-yl)methanamine is sourced from PubChem (CID 123426765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).