1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one

C7H15N2OP — CID 20715761

IUPAC1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one
SMILESCC1C(CN(C)P)C(=O)N1C
InChIInChI=1S/C7H15N2OP/c1-5-6(4-8(2)11)7(10)9(5)3/h5-6H,4,11H2,1-3H3
InChIKeyXYZAOYRTTGELTH-UHFFFAOYSA-N
MW174.18 g/mol
LogP0.19
Rot. Bonds2

About 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one

1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one (PubChem CID 20715761) has the molecular formula C7H15N2OP and a molecular weight of 174.18 g/mol. Its IUPAC name is 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one.

Molecular Properties

Compound Name1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one
PubChem CID20715761
Molecular FormulaC7H15N2OP
Molecular Weight174.18 g/mol
Exact Mass174.09
IUPAC Name1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one
SMILESCC1C(CN(C)P)C(=O)N1C
InChIInChI=1S/C7H15N2OP/c1-5-6(4-8(2)11)7(10)9(5)3/h5-6H,4,11H2,1-3H3
InChIKeyXYZAOYRTTGELTH-UHFFFAOYSA-N
XLogP0.19
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.18
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,4-dimethyl-3-(2-phosphanylethyl)azetidin-2-one
CID 163862461
3-(aminomethyl)-1,4-dimethylazetidin-2-one
CID 20715925
(3S,4S)-1,4-dimethyl-3-prop-2-enylazetidin-2-one
CID 11286503
(3S,4R)-1,3,4-trimethylazetidin-2-one
CID 59947134
2-(1,2-dimethyl-4-oxoazetidin-3-yl)ethanimidamide
CID 20715800
1,2,4-trimethyl-5-oxopyrrolidine-3-carboxylic acid
CID 54373210
5-amino-2,3-dimethyl-1,3-thiazinan-4-one
CID 59888053
4-(aminomethyl)-3-methyl-3-azabicyclo[3.1.0]hexan-2-one
CID 105428130
2-(2-bromoethyl)-5-methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 114512941
(4S,5S)-1,3,3,4,5-pentamethylpyrrolidin-2-one
CID 59868897
3-(hydroxymethyl)-1,2,5-trimethylpiperidin-4-one
CID 130026721
1,3-dimethyl-5-(sulfanylmethyl)imidazolidine-2,4-dione
CID 87233904

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one?
The IUPAC name of 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one (CID 20715761) is 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one.
What is the SMILES notation for 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one?
The canonical SMILES for 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one is CC1C(CN(C)P)C(=O)N1C.
What is the InChIKey of 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one?
The InChIKey is XYZAOYRTTGELTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N2OP/c1-5-6(4-8(2)11)7(10)9(5)3/h5-6H,4,11H2,1-3H3.
What are the key properties of 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one?
1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one has a molecular weight of 174.18 g/mol, XLogP of 0.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-3-[[methyl(phosphanyl)amino]methyl]azetidin-2-one is sourced from PubChem (CID 20715761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).