4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete

C10H19N — CID 135258022

IUPAC4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete
SMILESCC1C=C(CC(C)(C)C)N1C
InChIInChI=1S/C10H19N/c1-8-6-9(11(8)5)7-10(2,3)4/h6,8H,7H2,1-5H3
InChIKeyFWLIYLOQRHTEOI-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.64
Rot. Bonds1

About 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete

4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete (PubChem CID 135258022) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete.

Molecular Properties

Compound Name4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete
PubChem CID135258022
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete
SMILESCC1C=C(CC(C)(C)C)N1C
InChIInChI=1S/C10H19N/c1-8-6-9(11(8)5)7-10(2,3)4/h6,8H,7H2,1-5H3
InChIKeyFWLIYLOQRHTEOI-UHFFFAOYSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
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 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete?
The IUPAC name of 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete (CID 135258022) is 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete.
What is the SMILES notation for 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete?
The canonical SMILES for 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete is CC1C=C(CC(C)(C)C)N1C.
What is the InChIKey of 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete?
The InChIKey is FWLIYLOQRHTEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8-6-9(11(8)5)7-10(2,3)4/h6,8H,7H2,1-5H3.
What are the key properties of 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete?
4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete has a molecular weight of 153.27 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylpropyl)-1,2-dimethyl-2H-azete is sourced from PubChem (CID 135258022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).