2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide

C11H22N2O2 — CID 116678630

IUPAC2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
SMILESCC(C(=O)NCC(C)(C)CO)C1CNC1
InChIInChI=1S/C11H22N2O2/c1-8(9-4-12-5-9)10(15)13-6-11(2,3)7-14/h8-9,12,14H,4-7H2,1-3H3,(H,13,15)
InChIKeyNOUWYXILUPXLEI-UHFFFAOYSA-N
MW214.31 g/mol
LogP-0.02
Rot. Bonds5

About 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide

2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide (PubChem CID 116678630) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
PubChem CID116678630
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
SMILESCC(C(=O)NCC(C)(C)CO)C1CNC1
InChIInChI=1S/C11H22N2O2/c1-8(9-4-12-5-9)10(15)13-6-11(2,3)7-14/h8-9,12,14H,4-7H2,1-3H3,(H,13,15)
InChIKeyNOUWYXILUPXLEI-UHFFFAOYSA-N
XLogP-0.02
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-(2,3-dihydroxy-2-methylpropyl)propanamide
CID 116678297
2-(azetidin-3-yl)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]propanamide
CID 107852972
2-(azetidin-3-yl)-N-[2-(trifluoromethylsulfanyl)ethyl]propanamide
CID 106428265
2-(azetidin-3-yl)-N-[3-(tert-butylamino)-3-oxopropyl]propanamide
CID 116678902
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylpropyl)propanamide
CID 115360252
2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide
CID 116674271
2-(azetidin-3-yl)-N-(4-methylpentyl)propanamide
CID 116676839
2,2-difluoro-N-(3-hydroxy-2,2-dimethylpropyl)acetamide
CID 103513975
2-[2-(azetidin-3-yl)propanoylamino]propanoic acid
CID 116676916
2-(azetidin-3-yl)-N-octylpropanamide
CID 116678669
2-(azetidin-3-yl)-N-(5-methylhexyl)propanamide
CID 116678618
3-[2-(azetidin-3-yl)propanoylamino]-5,5-dimethylhexanoic acid
CID 116679069

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide (CID 116678630) is 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide is CC(C(=O)NCC(C)(C)CO)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide?
The InChIKey is NOUWYXILUPXLEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8(9-4-12-5-9)10(15)13-6-11(2,3)7-14/h8-9,12,14H,4-7H2,1-3H3,(H,13,15).
What are the key properties of 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide?
2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide has a molecular weight of 214.31 g/mol, XLogP of -0.02, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylpropyl)propanamide is sourced from PubChem (CID 116678630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).