3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine

C8H16NP — CID 131968280

IUPAC3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine
SMILESCC1(CC2(C)CP2)CNC1
InChIInChI=1S/C8H16NP/c1-7(4-9-5-7)3-8(2)6-10-8/h9-10H,3-6H2,1-2H3
InChIKeyOSGSJVCOINLSLP-UHFFFAOYSA-N
MW157.20 g/mol
LogP1.44
Rot. Bonds2

About 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine

3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine (PubChem CID 131968280) has the molecular formula C8H16NP and a molecular weight of 157.20 g/mol. Its IUPAC name is 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine.

Molecular Properties

Compound Name3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine
PubChem CID131968280
Molecular FormulaC8H16NP
Molecular Weight157.20 g/mol
Exact Mass157.10
IUPAC Name3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine
SMILESCC1(CC2(C)CP2)CNC1
InChIInChI=1S/C8H16NP/c1-7(4-9-5-7)3-8(2)6-10-8/h9-10H,3-6H2,1-2H3
InChIKeyOSGSJVCOINLSLP-UHFFFAOYSA-N
XLogP1.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-4-[(3-methylazetidin-3-yl)methyl]piperazine
CID 130854837
3-butyl-3-methylazetidine;ethane
CID 145389820
3-(4,4-dimethylpentyl)-3-methylazetidine
CID 176961474
3-methyl-3-(methylsulfonylmethyl)azetidine;hydrochloride
CID 139026879
N,2-dimethyl-N-[(3-methylazetidin-3-yl)methyl]propan-2-amine
CID 130806357
3-[(3-bromo-2,6-difluorophenyl)methyl]-3-methylazetidine
CID 106273157
1,5-dimethyl-3-azabicyclo[3.1.0]hexane
CID 23049859
1,5-dimethyl-3-azabicyclo[3.2.0]heptane
CID 23049848
3-methyl-N-[(3-methylazetidin-3-yl)methyl]cyclopentan-1-amine
CID 130871122
6-ethyl-6-methyl-1,4-thiazepane
CID 166825864
ethane;2,2,6,6-tetramethylpiperazine
CID 178166936
3,5-dimethyl-3-(2-methylpropyl)piperidine
CID 130351584

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine?
The IUPAC name of 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine (CID 131968280) is 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine.
What is the SMILES notation for 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine?
The canonical SMILES for 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine is CC1(CC2(C)CP2)CNC1.
What is the InChIKey of 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine?
The InChIKey is OSGSJVCOINLSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NP/c1-7(4-9-5-7)3-8(2)6-10-8/h9-10H,3-6H2,1-2H3.
What are the key properties of 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine?
3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine has a molecular weight of 157.20 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-[(2-methylphosphiran-2-yl)methyl]azetidine is sourced from PubChem (CID 131968280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).