1-methyl-2-propan-2-ylazetidine

C7H15N — CID 23588958

IUPAC1-methyl-2-propan-2-ylazetidine
SMILESCC(C)C1CCN1C
InChIInChI=1S/C7H15N/c1-6(2)7-4-5-8(7)3/h6-7H,4-5H2,1-3H3
InChIKeyBOWGTHDZYMIPLD-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.35
Rot. Bonds1

About 1-methyl-2-propan-2-ylazetidine

1-methyl-2-propan-2-ylazetidine (PubChem CID 23588958) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is 1-methyl-2-propan-2-ylazetidine.

Molecular Properties

Compound Name1-methyl-2-propan-2-ylazetidine
PubChem CID23588958
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name1-methyl-2-propan-2-ylazetidine
SMILESCC(C)C1CCN1C
InChIInChI=1S/C7H15N/c1-6(2)7-4-5-8(7)3/h6-7H,4-5H2,1-3H3
InChIKeyBOWGTHDZYMIPLD-UHFFFAOYSA-N
XLogP1.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-propan-2-ylazetidine?
The IUPAC name of 1-methyl-2-propan-2-ylazetidine (CID 23588958) is 1-methyl-2-propan-2-ylazetidine.
What is the SMILES notation for 1-methyl-2-propan-2-ylazetidine?
The canonical SMILES for 1-methyl-2-propan-2-ylazetidine is CC(C)C1CCN1C.
What is the InChIKey of 1-methyl-2-propan-2-ylazetidine?
The InChIKey is BOWGTHDZYMIPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-6(2)7-4-5-8(7)3/h6-7H,4-5H2,1-3H3.
What are the key properties of 1-methyl-2-propan-2-ylazetidine?
1-methyl-2-propan-2-ylazetidine has a molecular weight of 113.20 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-propan-2-ylazetidine is sourced from PubChem (CID 23588958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).