N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide

C13H19NO4 — CID 112508973

IUPACN-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)N(CCO)CC(C)O
InChIInChI=1S/C13H19NO4/c1-10(16)9-14(7-8-15)13(17)11-5-3-4-6-12(11)18-2/h3-6,10,15-16H,7-9H2,1-2H3
InChIKeyGEGGRWUYZVFWPF-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.51
Rot. Bonds6

About N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide

N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide (PubChem CID 112508973) has the molecular formula C13H19NO4 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide
PubChem CID112508973
Molecular FormulaC13H19NO4
Molecular Weight253.30 g/mol
Exact Mass253.13
IUPAC NameN-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)N(CCO)CC(C)O
InChIInChI=1S/C13H19NO4/c1-10(16)9-14(7-8-15)13(17)11-5-3-4-6-12(11)18-2/h3-6,10,15-16H,7-9H2,1-2H3
InChIKeyGEGGRWUYZVFWPF-UHFFFAOYSA-N
XLogP0.51
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-hydroxypropyl-(2-methoxybenzoyl)amino]propanoic acid
CID 82324912
3-[2-hydroxypropyl-(2-methoxybenzoyl)amino]-2-methylpropanoic acid
CID 82324930
2-methoxy-N,N-bis(2-methoxyethyl)benzamide
CID 51072625
N-(1-hydroxy-1-phenylpropan-2-yl)-2-methoxy-N-methylbenzamide
CID 54856631
N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612911
N-[(2S)-1-amino-3-methylbutan-2-yl]-2-methoxy-N-methylbenzamide
CID 131998525
N-(2-chloroethyl)-N-ethyl-2-methoxybenzamide
CID 63395082
2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-N-propylbenzamide
CID 60655994
N-(2-aminophenyl)-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 43547919
3-[carboxymethyl-(2-methoxybenzoyl)amino]propanoic acid
CID 82324907
2-methoxy-N-methyl-N-[(2R)-1-methylsulfonylpropan-2-yl]benzamide
CID 95171532
N-ethyl-2-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 18155625

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide?
The IUPAC name of N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide (CID 112508973) is N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide is COc1ccccc1C(=O)N(CCO)CC(C)O.
What is the InChIKey of N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide?
The InChIKey is GEGGRWUYZVFWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO4/c1-10(16)9-14(7-8-15)13(17)11-5-3-4-6-12(11)18-2/h3-6,10,15-16H,7-9H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide?
N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide has a molecular weight of 253.30 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-(2-hydroxypropyl)-2-methoxybenzamide is sourced from PubChem (CID 112508973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).