1-(2,4-dimethylpent-2-en-3-yl)azetidine

C10H19N — CID 155036780

IUPAC1-(2,4-dimethylpent-2-en-3-yl)azetidine
SMILESCC(C)=C(C(C)C)N1CCC1
InChIInChI=1S/C10H19N/c1-8(2)10(9(3)4)11-6-5-7-11/h8H,5-7H2,1-4H3
InChIKeySOHHVCNMCOTKFX-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.64
Rot. Bonds2

About 1-(2,4-dimethylpent-2-en-3-yl)azetidine

1-(2,4-dimethylpent-2-en-3-yl)azetidine (PubChem CID 155036780) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-(2,4-dimethylpent-2-en-3-yl)azetidine.

Molecular Properties

Compound Name1-(2,4-dimethylpent-2-en-3-yl)azetidine
PubChem CID155036780
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-(2,4-dimethylpent-2-en-3-yl)azetidine
SMILESCC(C)=C(C(C)C)N1CCC1
InChIInChI=1S/C10H19N/c1-8(2)10(9(3)4)11-6-5-7-11/h8H,5-7H2,1-4H3
InChIKeySOHHVCNMCOTKFX-UHFFFAOYSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylpent-2-en-3-yl)azetidine?
The IUPAC name of 1-(2,4-dimethylpent-2-en-3-yl)azetidine (CID 155036780) is 1-(2,4-dimethylpent-2-en-3-yl)azetidine.
What is the SMILES notation for 1-(2,4-dimethylpent-2-en-3-yl)azetidine?
The canonical SMILES for 1-(2,4-dimethylpent-2-en-3-yl)azetidine is CC(C)=C(C(C)C)N1CCC1.
What is the InChIKey of 1-(2,4-dimethylpent-2-en-3-yl)azetidine?
The InChIKey is SOHHVCNMCOTKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8(2)10(9(3)4)11-6-5-7-11/h8H,5-7H2,1-4H3.
What are the key properties of 1-(2,4-dimethylpent-2-en-3-yl)azetidine?
1-(2,4-dimethylpent-2-en-3-yl)azetidine has a molecular weight of 153.27 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylpent-2-en-3-yl)azetidine is sourced from PubChem (CID 155036780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).