2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide

C14H20N2O3 — CID 86150201

IUPAC2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide
SMILESCC(C)NCC(=O)COc1ccc(CC(N)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,16H,7-9H2,1-2H3,(H2,15,18)
InChIKeySXJUENPYXDHTLC-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.66
Rot. Bonds8

About 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide

2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide (PubChem CID 86150201) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide
PubChem CID86150201
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide
SMILESCC(C)NCC(=O)COc1ccc(CC(N)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,16H,7-9H2,1-2H3,(H2,15,18)
InChIKeySXJUENPYXDHTLC-UHFFFAOYSA-N
XLogP0.66
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-benzoylphenoxy)-3-(propan-2-ylamino)propan-2-one
CID 20507347
ethyl (2S)-2-[[2-[4-(2-amino-2-oxoethyl)phenoxy]acetyl]amino]propanoate
CID 95762944
2-[4-(3-nitro-2-oxopropoxy)phenyl]acetamide
CID 20617578
(2S)-2-[[4-(2-amino-2-oxoethoxy)phenyl]methylamino]propanamide
CID 39756608
2-[4-(2-hydroxypropyl)phenoxy]acetamide
CID 115495800
2-[4-[2-oxo-2-[[3-(propan-2-yloxymethyl)phenyl]methylamino]ethoxy]phenyl]acetamide
CID 48677738
2-[4-(propan-2-ylamino)phenoxy]acetamide
CID 43711183
2-[4-[2-(methylamino)propyl]phenoxy]acetamide
CID 115494731
2-[4-[2-oxo-2-(propan-2-ylcarbamoylamino)ethoxy]phenyl]acetic acid
CID 43214810
2-[4-(2,3-dihydroxypropoxy)phenyl]acetamide
CID 572441
2-[4-[3-[di(propan-2-yl)amino]-2-hydroxypropoxy]phenyl]acetamide
CID 59432769
2-[4-[2-(4-bromophenyl)-2-oxoethoxy]phenyl]acetamide
CID 38113386

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide?
The IUPAC name of 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide (CID 86150201) is 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide.
What is the SMILES notation for 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide?
The canonical SMILES for 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide is CC(C)NCC(=O)COc1ccc(CC(N)=O)cc1.
What is the InChIKey of 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide?
The InChIKey is SXJUENPYXDHTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,16H,7-9H2,1-2H3,(H2,15,18).
What are the key properties of 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide?
2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide has a molecular weight of 264.32 g/mol, XLogP of 0.66, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-oxo-3-(propan-2-ylamino)propoxy]phenyl]acetamide is sourced from PubChem (CID 86150201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).