N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide

C11H13N3O5 — CID 107689376

IUPACN,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide
SMILESNC(=O)CN(CC(N)=O)C(=O)c1c(O)cccc1O
InChIInChI=1S/C11H13N3O5/c12-8(17)4-14(5-9(13)18)11(19)10-6(15)2-1-3-7(10)16/h1-3,15-16H,4-5H2,(H2,12,17)(H2,13,18)
InChIKeyUOKVKAZNKLOIRV-UHFFFAOYSA-N
MW267.24 g/mol
LogP-1.49
Rot. Bonds5

About N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide

N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide (PubChem CID 107689376) has the molecular formula C11H13N3O5 and a molecular weight of 267.24 g/mol. Its IUPAC name is N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide.

Molecular Properties

Compound NameN,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide
PubChem CID107689376
Molecular FormulaC11H13N3O5
Molecular Weight267.24 g/mol
Exact Mass267.09
IUPAC NameN,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide
SMILESNC(=O)CN(CC(N)=O)C(=O)c1c(O)cccc1O
InChIInChI=1S/C11H13N3O5/c12-8(17)4-14(5-9(13)18)11(19)10-6(15)2-1-3-7(10)16/h1-3,15-16H,4-5H2,(H2,12,17)(H2,13,18)
InChIKeyUOKVKAZNKLOIRV-UHFFFAOYSA-N
XLogP-1.49
TPSA146.95 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.24
LogP ≤ 5-1.49
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-amino-2-oxoethyl)-(2,6-dimethoxybenzoyl)amino]acetic acid
CID 107433700
N,N-bis(2-amino-2-oxoethyl)-3-nitrobenzamide
CID 20505193
2-[(2,6-dihydroxybenzoyl)-(2-methylpropyl)amino]acetic acid
CID 107687977
2-[(2-amino-2-oxoethyl)-(3,4-dihydroxybenzoyl)amino]acetic acid
CID 107728235
N-ethyl-2,6-dihydroxy-N-(3-hydroxypropyl)benzamide
CID 107689617
N-(2-amino-2-oxoethyl)-N-butyl-2,3-dihydroxybenzamide
CID 114344176
2-[(2-amino-2-oxoethyl)-(2,4-dihydroxybenzoyl)amino]acetic acid
CID 107434887
methyl 3-[(2,6-dihydroxybenzoyl)-(2-methoxyethyl)amino]propanoate
CID 107689507
N-(2-amino-2-oxoethyl)-N-butyl-2-hydroxybenzamide
CID 54942284
2-[(2-amino-2-oxoethyl)-(2-hydroxy-3-methoxybenzoyl)amino]acetic acid
CID 107433916
N-(2-amino-2-oxoethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82829163
2-amino-N-(2-amino-2-oxoethyl)-N-butyl-6-chlorobenzamide
CID 63658073

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide?
The IUPAC name of N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide (CID 107689376) is N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide.
What is the SMILES notation for N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide?
The canonical SMILES for N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide is NC(=O)CN(CC(N)=O)C(=O)c1c(O)cccc1O.
What is the InChIKey of N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide?
The InChIKey is UOKVKAZNKLOIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O5/c12-8(17)4-14(5-9(13)18)11(19)10-6(15)2-1-3-7(10)16/h1-3,15-16H,4-5H2,(H2,12,17)(H2,13,18).
What are the key properties of N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide?
N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide has a molecular weight of 267.24 g/mol, XLogP of -1.49, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-amino-2-oxoethyl)-2,6-dihydroxybenzamide is sourced from PubChem (CID 107689376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).