2-(oxolan-2-yl)propan-2-amine

C7H15NO — CID 21054636

IUPAC2-(oxolan-2-yl)propan-2-amine
SMILESCC(C)(N)C1CCCO1
InChIInChI=1S/C7H15NO/c1-7(2,8)6-4-3-5-9-6/h6H,3-5,8H2,1-2H3
InChIKeyMWACBPJCVXUVAR-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.90
Rot. Bonds1

About 2-(oxolan-2-yl)propan-2-amine

2-(oxolan-2-yl)propan-2-amine (PubChem CID 21054636) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-(oxolan-2-yl)propan-2-amine.

Molecular Properties

Compound Name2-(oxolan-2-yl)propan-2-amine
PubChem CID21054636
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-(oxolan-2-yl)propan-2-amine
SMILESCC(C)(N)C1CCCO1
InChIInChI=1S/C7H15NO/c1-7(2,8)6-4-3-5-9-6/h6H,3-5,8H2,1-2H3
InChIKeyMWACBPJCVXUVAR-UHFFFAOYSA-N
XLogP0.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)propan-2-amine?
The IUPAC name of 2-(oxolan-2-yl)propan-2-amine (CID 21054636) is 2-(oxolan-2-yl)propan-2-amine.
What is the SMILES notation for 2-(oxolan-2-yl)propan-2-amine?
The canonical SMILES for 2-(oxolan-2-yl)propan-2-amine is CC(C)(N)C1CCCO1.
What is the InChIKey of 2-(oxolan-2-yl)propan-2-amine?
The InChIKey is MWACBPJCVXUVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-7(2,8)6-4-3-5-9-6/h6H,3-5,8H2,1-2H3.
What are the key properties of 2-(oxolan-2-yl)propan-2-amine?
2-(oxolan-2-yl)propan-2-amine has a molecular weight of 129.20 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)propan-2-amine is sourced from PubChem (CID 21054636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).