2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide

C14H20N2O3 — CID 60682639

IUPAC2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCOc1cccc(C(=O)NCCN2CCCC2)c1O
InChIInChI=1S/C14H20N2O3/c1-19-12-6-4-5-11(13(12)17)14(18)15-7-10-16-8-2-3-9-16/h4-6,17H,2-3,7-10H2,1H3,(H,15,18)
InChIKeyLWJTZEGBRUNJAX-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.23
Rot. Bonds5

About 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide

2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide (PubChem CID 60682639) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
PubChem CID60682639
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCOc1cccc(C(=O)NCCN2CCCC2)c1O
InChIInChI=1S/C14H20N2O3/c1-19-12-6-4-5-11(13(12)17)14(18)15-7-10-16-8-2-3-9-16/h4-6,17H,2-3,7-10H2,1H3,(H,15,18)
InChIKeyLWJTZEGBRUNJAX-UHFFFAOYSA-N
XLogP1.23
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[2-(4-methyl-1,4-diazepan-1-yl)ethyl]benzamide
CID 142795437
2-hydroxy-3-methoxy-N-(2-pyrazol-1-ylethyl)benzamide
CID 61460888
N-[3-methoxy-2-(2-piperidin-1-ylethylcarbamoyl)phenyl]naphthalene-1-carboxamide
CID 11647671
2-methoxy-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide
CID 747202
3-hydroxy-4-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 79725500
N-[2-(ethylamino)ethyl]-2-hydroxy-3-methoxybenzamide
CID 62656877
2-methoxy-N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]benzamide
CID 47790621
2-hydroxy-3-methyl-N-(3-pyrrolidin-1-ylpropyl)benzamide
CID 60712545
2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
CID 2941366
2-(2-pyrrolidin-1-ylethylcarbamoyl)benzoic acid;hydrate
CID 21152769
2-methoxy-1-N-(2-piperidin-1-ylethyl)benzene-1,4-dicarboxamide
CID 68809387
2,3-dichloro-N-(2-piperidin-1-ylethyl)benzamide
CID 17173706

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The IUPAC name of 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide (CID 60682639) is 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide.
What is the SMILES notation for 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The canonical SMILES for 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is COc1cccc(C(=O)NCCN2CCCC2)c1O.
What is the InChIKey of 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The InChIKey is LWJTZEGBRUNJAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-19-12-6-4-5-11(13(12)17)14(18)15-7-10-16-8-2-3-9-16/h4-6,17H,2-3,7-10H2,1H3,(H,15,18).
What are the key properties of 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is sourced from PubChem (CID 60682639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).