2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide

C13H18N2O2 — CID 106608014

IUPAC2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCN(CC1CCCN1)C(=O)c1ccccc1O
InChIInChI=1S/C13H18N2O2/c1-15(9-10-5-4-8-14-10)13(17)11-6-2-3-7-12(11)16/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3
InChIKeyPPORTXLLLVWYCR-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.22
Rot. Bonds3

About 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide

2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide (PubChem CID 106608014) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
PubChem CID106608014
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCN(CC1CCCN1)C(=O)c1ccccc1O
InChIInChI=1S/C13H18N2O2/c1-15(9-10-5-4-8-14-10)13(17)11-6-2-3-7-12(11)16/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3
InChIKeyPPORTXLLLVWYCR-UHFFFAOYSA-N
XLogP1.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide?
The IUPAC name of 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide (CID 106608014) is 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide?
The canonical SMILES for 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide is CN(CC1CCCN1)C(=O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide?
The InChIKey is PPORTXLLLVWYCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-15(9-10-5-4-8-14-10)13(17)11-6-2-3-7-12(11)16/h2-3,6-7,10,14,16H,4-5,8-9H2,1H3.
What are the key properties of 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide?
2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide has a molecular weight of 234.30 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide is sourced from PubChem (CID 106608014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).