2-methyloxetane;propan-2-amine

C7H17NO — CID 18626824

IUPAC2-methyloxetane;propan-2-amine
SMILESCC(C)N.CC1CCO1
InChIInChI=1S/C4H8O.C3H9N/c1-4-2-3-5-4;1-3(2)4/h4H,2-3H2,1H3;3H,4H2,1-2H3
InChIKeyZJXWYULZWBSKPH-UHFFFAOYSA-N
MW131.22 g/mol
LogP1.15
Rot. Bonds

About 2-methyloxetane;propan-2-amine

2-methyloxetane;propan-2-amine (PubChem CID 18626824) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is 2-methyloxetane;propan-2-amine.

Molecular Properties

Compound Name2-methyloxetane;propan-2-amine
PubChem CID18626824
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name2-methyloxetane;propan-2-amine
SMILESCC(C)N.CC1CCO1
InChIInChI=1S/C4H8O.C3H9N/c1-4-2-3-5-4;1-3(2)4/h4H,2-3H2,1H3;3H,4H2,1-2H3
InChIKeyZJXWYULZWBSKPH-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyloxetane;propan-2-amine?
The IUPAC name of 2-methyloxetane;propan-2-amine (CID 18626824) is 2-methyloxetane;propan-2-amine.
What is the SMILES notation for 2-methyloxetane;propan-2-amine?
The canonical SMILES for 2-methyloxetane;propan-2-amine is CC(C)N.CC1CCO1.
What is the InChIKey of 2-methyloxetane;propan-2-amine?
The InChIKey is ZJXWYULZWBSKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.C3H9N/c1-4-2-3-5-4;1-3(2)4/h4H,2-3H2,1H3;3H,4H2,1-2H3.
What are the key properties of 2-methyloxetane;propan-2-amine?
2-methyloxetane;propan-2-amine has a molecular weight of 131.22 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyloxetane;propan-2-amine is sourced from PubChem (CID 18626824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).