N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine

C9H15N3O — CID 66185057

IUPACN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine
SMILESCc1cc(CN(C)C2CNC2)on1
InChIInChI=1S/C9H15N3O/c1-7-3-9(13-11-7)6-12(2)8-4-10-5-8/h3,8,10H,4-6H2,1-2H3
InChIKeyZHOKDDOSQFYYSV-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.39
Rot. Bonds3

About N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine

N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine (PubChem CID 66185057) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine
PubChem CID66185057
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC NameN-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine
SMILESCc1cc(CN(C)C2CNC2)on1
InChIInChI=1S/C9H15N3O/c1-7-3-9(13-11-7)6-12(2)8-4-10-5-8/h3,8,10H,4-6H2,1-2H3
InChIKeyZHOKDDOSQFYYSV-UHFFFAOYSA-N
XLogP0.39
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-methyl-4-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclohexane-1,4-diamine
CID 79121827
2-[methyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]cyclobutan-1-ol
CID 126856628
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-N-propylpiperidin-3-amine
CID 63637151
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylazetidin-3-amine
CID 66186598
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 79714350
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106639763
5-[(2,6-dimethylpiperazin-1-yl)methyl]-3-methyl-1,2-oxazole
CID 63910440
N-[(2S)-3-methylbutan-2-yl]-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropanamine
CID 95289560
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-N-(piperidin-4-ylmethyl)ethanamine
CID 79716550
N-[(4-chloro-6-methylpyrimidin-2-yl)methyl]-N-methylazetidin-3-amine
CID 80664747
N,3-dimethyl-N-pyrrolidin-3-yl-1,2-oxazole-5-carboxamide
CID 63297787
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-N-methylazetidin-3-amine
CID 66186647

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine?
The IUPAC name of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine (CID 66185057) is N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine.
What is the SMILES notation for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine?
The canonical SMILES for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine is Cc1cc(CN(C)C2CNC2)on1.
What is the InChIKey of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine?
The InChIKey is ZHOKDDOSQFYYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7-3-9(13-11-7)6-12(2)8-4-10-5-8/h3,8,10H,4-6H2,1-2H3.
What are the key properties of N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine?
N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine has a molecular weight of 181.24 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]azetidin-3-amine is sourced from PubChem (CID 66185057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).