2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide

C15H22N2O2 — CID 116675260

IUPAC2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)C(C)C1CNC1
InChIInChI=1S/C15H22N2O2/c1-3-8-19-14-7-5-4-6-13(14)17-15(18)11(2)12-9-16-10-12/h4-7,11-12,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyJWNHBKWOKRQMCL-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.27
Rot. Bonds6

About 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide

2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide (PubChem CID 116675260) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide
PubChem CID116675260
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)C(C)C1CNC1
InChIInChI=1S/C15H22N2O2/c1-3-8-19-14-7-5-4-6-13(14)17-15(18)11(2)12-9-16-10-12/h4-7,11-12,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyJWNHBKWOKRQMCL-UHFFFAOYSA-N
XLogP2.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 116674736
2-(azetidin-3-yl)-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 116674418
2-(azetidin-3-yl)-N-naphthalen-1-ylpropanamide
CID 116674289
2-(azetidin-3-yl)-N-(2-iodophenyl)propanamide
CID 116674715
2-amino-N-(2-propoxyphenyl)pentanamide
CID 43702443
1-[(1-hydroxycyclopentyl)methyl]-3-(2-propoxyphenyl)urea
CID 111103515
methyl N-(2-propoxyphenyl)carbamate
CID 19872099
1-cyclohexyl-3-(2-propoxyphenyl)urea
CID 47103328
1-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-propoxyphenyl)urea
CID 110911298
1-(4-hydroxy-2-methylpentyl)-3-(2-propoxyphenyl)urea
CID 111452855
1-[(4-fluorophenyl)methyl]-3-(2-propoxyphenyl)urea
CID 38197539
1,3-bis(2-butoxyphenyl)urea
CID 17170447

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide (CID 116675260) is 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide is CCCOc1ccccc1NC(=O)C(C)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide?
The InChIKey is JWNHBKWOKRQMCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-8-19-14-7-5-4-6-13(14)17-15(18)11(2)12-9-16-10-12/h4-7,11-12,16H,3,8-10H2,1-2H3,(H,17,18).
What are the key properties of 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide?
2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(2-propoxyphenyl)propanamide is sourced from PubChem (CID 116675260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).