2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide

C14H20N2O3 — CID 114761721

IUPAC2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCC2(C)CCCN2)c(O)c1
InChIInChI=1S/C14H20N2O3/c1-14(6-3-7-16-14)9-15-13(18)11-5-4-10(19-2)8-12(11)17/h4-5,8,16-17H,3,6-7,9H2,1-2H3,(H,15,18)
InChIKeyBMVOKZQCZFUOHK-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.27
Rot. Bonds4

About 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide

2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide (PubChem CID 114761721) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
PubChem CID114761721
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCC2(C)CCCN2)c(O)c1
InChIInChI=1S/C14H20N2O3/c1-14(6-3-7-16-14)9-15-13(18)11-5-4-10(19-2)8-12(11)17/h4-5,8,16-17H,3,6-7,9H2,1-2H3,(H,15,18)
InChIKeyBMVOKZQCZFUOHK-UHFFFAOYSA-N
XLogP1.27
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dihydroxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 107721880
2-hydroxy-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methoxybenzamide
CID 115701396
N-[[1-(bromomethyl)cyclopentyl]methyl]-2-hydroxy-4-methoxybenzamide
CID 115364295
3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 114761937
2-hydroxy-4-methoxy-N-(1-methylcyclobutyl)benzamide
CID 113346628
2-fluoro-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 114761726
N-[1-(bromomethyl)cyclopentyl]-2-hydroxy-4-methoxybenzamide
CID 114311329
2-hydroxy-4-methoxy-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide;hydrochloride
CID 154917317
2-hydroxy-N-[(1-hydroxycyclohexyl)methyl]-5-methoxybenzamide
CID 65113519
2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
CID 51186865
2-hydroxy-4-methoxy-N-(2-methylprop-2-enyl)benzamide
CID 114617408
2-hydroxy-4-methoxy-N-(3-methoxypropyl)benzamide
CID 43090058

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide (CID 114761721) is 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide is COc1ccc(C(=O)NCC2(C)CCCN2)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The InChIKey is BMVOKZQCZFUOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-14(6-3-7-16-14)9-15-13(18)11-5-4-10(19-2)8-12(11)17/h4-5,8,16-17H,3,6-7,9H2,1-2H3,(H,15,18).
What are the key properties of 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.27, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide is sourced from PubChem (CID 114761721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).