2-chloro-5-(2-methoxypropanoylamino)benzamide

C11H13ClN2O3 — CID 47303789

IUPAC2-chloro-5-(2-methoxypropanoylamino)benzamide
SMILESCOC(C)C(=O)Nc1ccc(Cl)c(C(N)=O)c1
InChIInChI=1S/C11H13ClN2O3/c1-6(17-2)11(16)14-7-3-4-9(12)8(5-7)10(13)15/h3-6H,1-2H3,(H2,13,15)(H,14,16)
InChIKeyVNUWDDYYVDSKST-UHFFFAOYSA-N
MW256.69 g/mol
LogP1.41
Rot. Bonds4

About 2-chloro-5-(2-methoxypropanoylamino)benzamide

2-chloro-5-(2-methoxypropanoylamino)benzamide (PubChem CID 47303789) has the molecular formula C11H13ClN2O3 and a molecular weight of 256.69 g/mol. Its IUPAC name is 2-chloro-5-(2-methoxypropanoylamino)benzamide.

Molecular Properties

Compound Name2-chloro-5-(2-methoxypropanoylamino)benzamide
PubChem CID47303789
Molecular FormulaC11H13ClN2O3
Molecular Weight256.69 g/mol
Exact Mass256.06
IUPAC Name2-chloro-5-(2-methoxypropanoylamino)benzamide
SMILESCOC(C)C(=O)Nc1ccc(Cl)c(C(N)=O)c1
InChIInChI=1S/C11H13ClN2O3/c1-6(17-2)11(16)14-7-3-4-9(12)8(5-7)10(13)15/h3-6H,1-2H3,(H2,13,15)(H,14,16)
InChIKeyVNUWDDYYVDSKST-UHFFFAOYSA-N
XLogP1.41
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-5-(2-methoxypropanoylamino)benzoic acid
CID 112685827
5-[(2-bromo-3-methylbutanoyl)amino]-2-chlorobenzamide
CID 43699184
2-chloro-5-[[3-(ethylamino)-2-methylpropanoyl]amino]benzamide
CID 55122685
2-chloro-5-[[2-(4-chlorophenyl)-3-methylbutanoyl]amino]benzamide
CID 43055354
5-[[(2S)-2-aminopentanoyl]amino]-2-chlorobenzamide
CID 107568557
N-[4-(carbamoylamino)phenyl]-2-methoxypropanamide
CID 47311851
N-(3-chloro-4-propan-2-yloxyphenyl)-2-methoxypropanamide
CID 47306002
5-[[(2S)-2-amino-2-phenylacetyl]amino]-2-chlorobenzamide
CID 104897291
N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxypropanamide
CID 115875463
2-chloro-5-(2-phenylbutanoylamino)benzamide
CID 42949295
N-(3-amino-4-fluorophenyl)-2-methoxypropanamide
CID 16793944
(2R)-2-[(E)-[(2R)-1-amino-2-methoxypropylidene]amino]oxy-N-(3-chloro-4-methoxyphenyl)propanamide
CID 95971723

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2-methoxypropanoylamino)benzamide?
The IUPAC name of 2-chloro-5-(2-methoxypropanoylamino)benzamide (CID 47303789) is 2-chloro-5-(2-methoxypropanoylamino)benzamide.
What is the SMILES notation for 2-chloro-5-(2-methoxypropanoylamino)benzamide?
The canonical SMILES for 2-chloro-5-(2-methoxypropanoylamino)benzamide is COC(C)C(=O)Nc1ccc(Cl)c(C(N)=O)c1.
What is the InChIKey of 2-chloro-5-(2-methoxypropanoylamino)benzamide?
The InChIKey is VNUWDDYYVDSKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O3/c1-6(17-2)11(16)14-7-3-4-9(12)8(5-7)10(13)15/h3-6H,1-2H3,(H2,13,15)(H,14,16).
What are the key properties of 2-chloro-5-(2-methoxypropanoylamino)benzamide?
2-chloro-5-(2-methoxypropanoylamino)benzamide has a molecular weight of 256.69 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2-methoxypropanoylamino)benzamide is sourced from PubChem (CID 47303789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).