5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide

C13H17ClN2O3 — CID 49167744

IUPAC5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
SMILESCC(C)CNC(=O)CNC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C13H17ClN2O3/c1-8(2)6-15-12(18)7-16-13(19)10-5-9(14)3-4-11(10)17/h3-5,8,17H,6-7H2,1-2H3,(H,15,18)(H,16,19)
InChIKeySPSNXDNZYYQTSL-UHFFFAOYSA-N
MW284.74 g/mol
LogP1.55
Rot. Bonds5

About 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide

5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide (PubChem CID 49167744) has the molecular formula C13H17ClN2O3 and a molecular weight of 284.74 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
PubChem CID49167744
Molecular FormulaC13H17ClN2O3
Molecular Weight284.74 g/mol
Exact Mass284.09
IUPAC Name5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
SMILESCC(C)CNC(=O)CNC(=O)c1cc(Cl)ccc1O
InChIInChI=1S/C13H17ClN2O3/c1-8(2)6-15-12(18)7-16-13(19)10-5-9(14)3-4-11(10)17/h3-5,8,17H,6-7H2,1-2H3,(H,15,18)(H,16,19)
InChIKeySPSNXDNZYYQTSL-UHFFFAOYSA-N
XLogP1.55
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.74
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 43402430
2-[(5-chloro-2-hydroxybenzoyl)amino]acetic acid
CID 15858288
5-chloro-2-hydroxy-N-(2-methylprop-2-enyl)benzamide
CID 114617404
5-chloro-N-(2-ethylbutyl)-2-hydroxybenzamide
CID 115613546
2-chloro-N-[2-(2-methylpropylamino)-2-oxoethyl]-5-sulfanylbenzamide
CID 107034416
5-chloro-N-(2-cyclopropylpropyl)-2-hydroxybenzamide
CID 115591206
5-chloro-2-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 47308839
2-fluoro-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 40623473
2-hydroxy-5-iodo-N-(2-methylpropyl)benzamide
CID 103600394
5-chloro-2-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43050180
5-chloro-N-(1-chloropropan-2-yl)-2-hydroxybenzamide
CID 114299358
3-amino-5-chloro-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 112687782

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide (CID 49167744) is 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide is CC(C)CNC(=O)CNC(=O)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
The InChIKey is SPSNXDNZYYQTSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O3/c1-8(2)6-15-12(18)7-16-13(19)10-5-9(14)3-4-11(10)17/h3-5,8,17H,6-7H2,1-2H3,(H,15,18)(H,16,19).
What are the key properties of 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide?
5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide has a molecular weight of 284.74 g/mol, XLogP of 1.55, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 49167744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).