4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide

C14H20N2O3 — CID 8946463

IUPAC4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide
SMILESC[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)NC(C)(C)C
InChIInChI=1S/C14H20N2O3/c1-9(13(18)16-14(2,3)4)19-11-7-5-10(6-8-11)12(15)17/h5-9H,1-4H3,(H2,15,17)(H,16,18)/t9-/m1/s1
InChIKeyKDUBPURGZCNJKS-SECBINFHSA-N
MW264.33 g/mol
LogP1.47
Rot. Bonds4

About 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide

4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide (PubChem CID 8946463) has the molecular formula C14H20N2O3 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide.

Molecular Properties

Compound Name4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide
PubChem CID8946463
Molecular FormulaC14H20N2O3
Molecular Weight264.33 g/mol
Exact Mass264.15
IUPAC Name4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide
SMILESC[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)NC(C)(C)C
InChIInChI=1S/C14H20N2O3/c1-9(13(18)16-14(2,3)4)19-11-7-5-10(6-8-11)12(15)17/h5-9H,1-4H3,(H2,15,17)(H,16,18)/t9-/m1/s1
InChIKeyKDUBPURGZCNJKS-SECBINFHSA-N
XLogP1.47
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-tert-butyl-2-(4-methoxyphenoxy)propanamide
CID 925163
2-[4-[(1S)-1-aminoethyl]phenoxy]-N-tert-butylpropanamide
CID 78933085
(2S)-N-tert-butyl-2-[4-(4-chlorobenzoyl)phenoxy]propanamide
CID 8887369
N-tert-butyl-2-(4-formylphenoxy)propanamide
CID 43086480
4-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]oxybenzamide
CID 7931426
N-tert-butyl-2-[4-(methylaminomethyl)phenoxy]propanamide
CID 43276886
4-[2-(4-methoxyphenoxy)propanoylamino]benzamide
CID 2952411
methyl 4-[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]oxybenzoate
CID 7667506
4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide
CID 7816278
4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7931427
4-[(2S)-1-(2-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7931375
[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl] (2R)-2-(4-cyanophenoxy)propanoate
CID 8855456

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide?
The IUPAC name of 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide (CID 8946463) is 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide.
What is the SMILES notation for 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide?
The canonical SMILES for 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide is C[C@@H](Oc1ccc(C(N)=O)cc1)C(=O)NC(C)(C)C.
What is the InChIKey of 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide?
The InChIKey is KDUBPURGZCNJKS-SECBINFHSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9(13(18)16-14(2,3)4)19-11-7-5-10(6-8-11)12(15)17/h5-9H,1-4H3,(H2,15,17)(H,16,18)/t9-/m1/s1.
What are the key properties of 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide?
4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide has a molecular weight of 264.33 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]oxybenzamide is sourced from PubChem (CID 8946463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).