N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide

C13H17NO4 — CID 43576768

IUPACN-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)N(CCO)C2CC2)c1O
InChIInChI=1S/C13H17NO4/c1-18-11-4-2-3-10(12(11)16)13(17)14(7-8-15)9-5-6-9/h2-4,9,15-16H,5-8H2,1H3
InChIKeyWCKUURJJEUQKGY-UHFFFAOYSA-N
MW251.28 g/mol
LogP1.00
Rot. Bonds5

About N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide

N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide (PubChem CID 43576768) has the molecular formula C13H17NO4 and a molecular weight of 251.28 g/mol. Its IUPAC name is N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide
PubChem CID43576768
Molecular FormulaC13H17NO4
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC NameN-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)N(CCO)C2CC2)c1O
InChIInChI=1S/C13H17NO4/c1-18-11-4-2-3-10(12(11)16)13(17)14(7-8-15)9-5-6-9/h2-4,9,15-16H,5-8H2,1H3
InChIKeyWCKUURJJEUQKGY-UHFFFAOYSA-N
XLogP1.00
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-N-propylbenzamide
CID 60655994
N-cyclopropyl-N-(2-hydroxyethyl)-2-(methoxymethyl)benzamide
CID 43576629
N-ethyl-2-hydroxy-3-methoxy-N-piperidin-3-ylbenzamide
CID 60807403
N-cyclopropyl-2-hydroxy-N-(2-methoxyethyl)-3-methylbenzamide
CID 60794549
N-cyclopropyl-2-(difluoromethoxy)-N-(2-hydroxyethyl)benzamide
CID 43576922
N-cyclopropyl-2,3-dihydroxy-N-propylbenzamide
CID 114343927
N-(2-amino-2-oxoethyl)-2-hydroxy-3-methoxy-N-pyrrolidin-3-ylbenzamide
CID 60806691
4-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 102867141
N-cyclopropyl-N-(2-hydroxyethyl)-3,4,5-trimethoxybenzamide
CID 43576979
2-hydroxy-3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 55026964
2-amino-3-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 115540101
N-cyclopropyl-N-(2-hydroxyethyl)-3-(2-methoxyphenyl)propanamide
CID 43577081

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide?
The IUPAC name of N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide (CID 43576768) is N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide.
What is the SMILES notation for N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide?
The canonical SMILES for N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide is COc1cccc(C(=O)N(CCO)C2CC2)c1O.
What is the InChIKey of N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide?
The InChIKey is WCKUURJJEUQKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO4/c1-18-11-4-2-3-10(12(11)16)13(17)14(7-8-15)9-5-6-9/h2-4,9,15-16H,5-8H2,1H3.
What are the key properties of N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide?
N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide has a molecular weight of 251.28 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide is sourced from PubChem (CID 43576768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).