2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide

C20H24N2O5 — CID 118988697

IUPAC2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide
SMILESO=C(NCCCC[C@@H](CO)NC(=O)c1ccccc1O)c1ccccc1O
InChIInChI=1S/C20H24N2O5/c23-13-14(22-20(27)16-9-2-4-11-18(16)25)7-5-6-12-21-19(26)15-8-1-3-10-17(15)24/h1-4,8-11,14,23-25H,5-7,12-13H2,(H,21,26)(H,22,27)/t14-/m0/s1
InChIKeyLHXWNUSSHMYIGT-AWEZNQCLSA-N
MW372.42 g/mol
LogP1.79
Rot. Bonds9

About 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide

2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide (PubChem CID 118988697) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide
PubChem CID118988697
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC Name2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide
SMILESO=C(NCCCC[C@@H](CO)NC(=O)c1ccccc1O)c1ccccc1O
InChIInChI=1S/C20H24N2O5/c23-13-14(22-20(27)16-9-2-4-11-18(16)25)7-5-6-12-21-19(26)15-8-1-3-10-17(15)24/h1-4,8-11,14,23-25H,5-7,12-13H2,(H,21,26)(H,22,27)/t14-/m0/s1
InChIKeyLHXWNUSSHMYIGT-AWEZNQCLSA-N
XLogP1.79
TPSA118.89 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 51.79
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,3-dihydroxy-N-[1-hydroxy-6-[(2-hydroxybenzoyl)amino]hexan-2-yl]benzamide
CID 163133324
N-[(5S)-5-[(2-chlorobenzoyl)amino]-6-hydroxyhexyl]-2,3-dihydroxybenzamide
CID 118988706
N-[6-[(2-fluoro-6-hydroxybenzoyl)amino]-1-hydroxyhexan-2-yl]-2,3-dihydroxybenzamide
CID 163126979
2,3-dihydroxy-N-[(2S)-1-hydroxy-6-[(2-hydroxy-3-methoxybenzoyl)amino]hexan-2-yl]benzamide
CID 139584659
N-[(5R)-6-amino-5-[(2,3-dihydroxybenzoyl)amino]hexyl]-2,3-dihydroxybenzamide
CID 10597288
2-hydroxy-N-[2-[2-[2-[(2-hydroxybenzoyl)amino]ethylamino]ethylamino]ethyl]benzamide
CID 101177175
N-(10-aminodecyl)-2-hydroxybenzamide;hydrochloride
CID 10268368
5-[(2-hydroxybenzoyl)amino]-2-methylpentanoic acid
CID 104681612
10-[(2-hydroxybenzoyl)amino]decanoate
CID 145137506
2-hydroxy-N-(10-oxoundecyl)benzamide
CID 21335630
2-hydroxy-N-(4-sulfanylhexadecyl)benzamide
CID 88819148
azanium 8-[(2-hydroxybenzoyl)amino]octanoate
CID 171364107

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide?
The IUPAC name of 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide (CID 118988697) is 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide?
The canonical SMILES for 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide is O=C(NCCCC[C@@H](CO)NC(=O)c1ccccc1O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide?
The InChIKey is LHXWNUSSHMYIGT-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H24N2O5/c23-13-14(22-20(27)16-9-2-4-11-18(16)25)7-5-6-12-21-19(26)15-8-1-3-10-17(15)24/h1-4,8-11,14,23-25H,5-7,12-13H2,(H,21,26)(H,22,27)/t14-/m0/s1.
What are the key properties of 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide?
2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide has a molecular weight of 372.42 g/mol, XLogP of 1.79, 9 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(5S)-6-hydroxy-5-[(2-hydroxybenzoyl)amino]hexyl]benzamide is sourced from PubChem (CID 118988697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).