1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine

C6H10N2 — CID 134484953

IUPAC1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine
SMILESC=c1n(C)c(=C)n1C
InChIInChI=1S/C6H10N2/c1-5-7(3)6(2)8(5)4/h1-2H2,3-4H3
InChIKeySMGRGRQEHZNYKQ-UHFFFAOYSA-N
MW110.16 g/mol
LogP-0.82
Rot. Bonds

About 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine

1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine (PubChem CID 134484953) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine.

Molecular Properties

Compound Name1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine
PubChem CID134484953
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine
SMILESC=c1n(C)c(=C)n1C
InChIInChI=1S/C6H10N2/c1-5-7(3)6(2)8(5)4/h1-2H2,3-4H3
InChIKeySMGRGRQEHZNYKQ-UHFFFAOYSA-N
XLogP-0.82
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 5-0.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine?
The IUPAC name of 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine (CID 134484953) is 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine.
What is the SMILES notation for 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine?
The canonical SMILES for 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine is C=c1n(C)c(=C)n1C.
What is the InChIKey of 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine?
The InChIKey is SMGRGRQEHZNYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-5-7(3)6(2)8(5)4/h1-2H2,3-4H3.
What are the key properties of 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine?
1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine has a molecular weight of 110.16 g/mol, XLogP of -0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2,4-dimethylidene-1,3-diazetidine is sourced from PubChem (CID 134484953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).