2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide

C14H20N2O2 — CID 104972264

IUPAC2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
SMILESCc1ccc(O)c(C(=O)NCC[C@@H]2CCCN2)c1
InChIInChI=1S/C14H20N2O2/c1-10-4-5-13(17)12(9-10)14(18)16-8-6-11-3-2-7-15-11/h4-5,9,11,15,17H,2-3,6-8H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyRBEWPAKFVAZIAR-NSHDSACASA-N
MW248.33 g/mol
LogP1.57
Rot. Bonds4

About 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide

2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide (PubChem CID 104972264) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
PubChem CID104972264
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
SMILESCc1ccc(O)c(C(=O)NCC[C@@H]2CCCN2)c1
InChIInChI=1S/C14H20N2O2/c1-10-4-5-13(17)12(9-10)14(18)16-8-6-11-3-2-7-15-11/h4-5,9,11,15,17H,2-3,6-8H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyRBEWPAKFVAZIAR-NSHDSACASA-N
XLogP1.57
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793749
2-bromo-4-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104971649
2,4-dihydroxy-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793797
2-(2,5-dimethylphenyl)-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]acetamide
CID 104955056
5-fluoro-2-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793819
6-methyl-4-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1H-pyridine-3-carboxamide
CID 104955353
2-ethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793888
3-chloro-2-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 107098372
2-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104972061
5-chloro-2-fluoro-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104955212
5-chloro-2-fluoro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104971959
1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide
CID 74231255

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide?
The IUPAC name of 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide (CID 104972264) is 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide.
What is the SMILES notation for 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide?
The canonical SMILES for 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide is Cc1ccc(O)c(C(=O)NCC[C@@H]2CCCN2)c1.
What is the InChIKey of 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide?
The InChIKey is RBEWPAKFVAZIAR-NSHDSACASA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-4-5-13(17)12(9-10)14(18)16-8-6-11-3-2-7-15-11/h4-5,9,11,15,17H,2-3,6-8H2,1H3,(H,16,18)/t11-/m0/s1.
What are the key properties of 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide?
2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.57, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide is sourced from PubChem (CID 104972264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).