(3R)-3-amino-1-tert-butylazetidin-2-one

C7H14N2O — CID 175542547

IUPAC(3R)-3-amino-1-tert-butylazetidin-2-one
SMILESCC(C)(C)N1C[C@@H](N)C1=O
InChIInChI=1S/C7H14N2O/c1-7(2,3)9-4-5(8)6(9)10/h5H,4,8H2,1-3H3/t5-/m1/s1
InChIKeyPPULACIXBNXLSB-RXMQYKEDSA-N
MW142.20 g/mol
LogP-0.05
Rot. Bonds

About (3R)-3-amino-1-tert-butylazetidin-2-one

(3R)-3-amino-1-tert-butylazetidin-2-one (PubChem CID 175542547) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (3R)-3-amino-1-tert-butylazetidin-2-one.

Molecular Properties

Compound Name(3R)-3-amino-1-tert-butylazetidin-2-one
PubChem CID175542547
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(3R)-3-amino-1-tert-butylazetidin-2-one
SMILESCC(C)(C)N1C[C@@H](N)C1=O
InChIInChI=1S/C7H14N2O/c1-7(2,3)9-4-5(8)6(9)10/h5H,4,8H2,1-3H3/t5-/m1/s1
InChIKeyPPULACIXBNXLSB-RXMQYKEDSA-N
XLogP-0.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-1-tert-butylazetidin-2-one?
The IUPAC name of (3R)-3-amino-1-tert-butylazetidin-2-one (CID 175542547) is (3R)-3-amino-1-tert-butylazetidin-2-one.
What is the SMILES notation for (3R)-3-amino-1-tert-butylazetidin-2-one?
The canonical SMILES for (3R)-3-amino-1-tert-butylazetidin-2-one is CC(C)(C)N1C[C@@H](N)C1=O.
What is the InChIKey of (3R)-3-amino-1-tert-butylazetidin-2-one?
The InChIKey is PPULACIXBNXLSB-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7(2,3)9-4-5(8)6(9)10/h5H,4,8H2,1-3H3/t5-/m1/s1.
What are the key properties of (3R)-3-amino-1-tert-butylazetidin-2-one?
(3R)-3-amino-1-tert-butylazetidin-2-one has a molecular weight of 142.20 g/mol, XLogP of -0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-1-tert-butylazetidin-2-one is sourced from PubChem (CID 175542547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).