1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine

C15H24N2 — CID 116906240

IUPAC1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine
SMILESCc1cc(C)c(C(C2CNC2)N(C)C)cc1C
InChIInChI=1S/C15H24N2/c1-10-6-12(3)14(7-11(10)2)15(17(4)5)13-8-16-9-13/h6-7,13,15-16H,8-9H2,1-5H3
InChIKeyJVMJRLXOTWPUGU-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.43
Rot. Bonds3

About 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine

1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine (PubChem CID 116906240) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine
PubChem CID116906240
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine
SMILESCc1cc(C)c(C(C2CNC2)N(C)C)cc1C
InChIInChI=1S/C15H24N2/c1-10-6-12(3)14(7-11(10)2)15(17(4)5)13-8-16-9-13/h6-7,13,15-16H,8-9H2,1-5H3
InChIKeyJVMJRLXOTWPUGU-UHFFFAOYSA-N
XLogP2.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)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

1-(azetidin-3-yl)-1-(2,5-dimethoxy-4-methylphenyl)-N,N-dimethylmethanamine
CID 116906242
azetidin-3-yl-(4,5-dimethoxy-2-methylphenyl)methanamine
CID 116935348
piperidin-4-yl-(2,4,5-trimethylphenyl)methanol
CID 80503850
N,N-dimethyl-2-pyrrolidin-2-yl-1-(2,4,5-trimethylphenyl)ethanamine
CID 116906674
N-methyl-N-(2,4,5-trimethylphenyl)azetidin-3-amine
CID 117040590
1-(azetidin-3-yl)-1-(3H-benzimidazol-5-yl)-N,N-dimethylmethanamine
CID 116906262
azetidin-3-yl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanamine
CID 116935315
morpholin-2-yl-(2,4,5-trimethylphenyl)methanamine
CID 116941022
N,N-dimethyl-1-(3-methylthiophen-2-yl)-1-piperidin-3-ylmethanamine
CID 116906601
2-cyclopropyl-1-(2,4,5-trimethylphenyl)propan-1-amine
CID 104990610
2-cyclopropyl-2-(2,4,5-trimethylphenyl)ethanamine
CID 82282694
1-(5-fluoro-2-methoxyphenyl)-N,N-dimethyl-1-piperidin-4-ylmethanamine
CID 82304521

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine?
The IUPAC name of 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine (CID 116906240) is 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine.
What is the SMILES notation for 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine?
The canonical SMILES for 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine is Cc1cc(C)c(C(C2CNC2)N(C)C)cc1C.
What is the InChIKey of 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine?
The InChIKey is JVMJRLXOTWPUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-10-6-12(3)14(7-11(10)2)15(17(4)5)13-8-16-9-13/h6-7,13,15-16H,8-9H2,1-5H3.
What are the key properties of 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine?
1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine has a molecular weight of 232.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-N,N-dimethyl-1-(2,4,5-trimethylphenyl)methanamine is sourced from PubChem (CID 116906240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).