2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide

C19H22N2O2 — CID 56559329

IUPAC2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccc(N3CCC(C)C3)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-13-3-8-18(22)17(11-13)19(23)20-15-4-6-16(7-5-15)21-10-9-14(2)12-21/h3-8,11,14,22H,9-10,12H2,1-2H3,(H,20,23)
InChIKeyFJKGWFPPRVMYAB-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.80
Rot. Bonds3

About 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide

2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide (PubChem CID 56559329) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
PubChem CID56559329
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccc(N3CCC(C)C3)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-13-3-8-18(22)17(11-13)19(23)20-15-4-6-16(7-5-15)21-10-9-14(2)12-21/h3-8,11,14,22H,9-10,12H2,1-2H3,(H,20,23)
InChIKeyFJKGWFPPRVMYAB-UHFFFAOYSA-N
XLogP3.80
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-chloro-4-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]benzamide
CID 21229733
N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-hydroxy-5-methylbenzamide
CID 17403854
2,4-dichloro-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56559113
2-iodo-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56559405
2,4-dimethyl-N-[4-[3-(2-methylpyrrolidin-1-yl)pyrrolidin-1-yl]phenyl]benzamide
CID 59401862
3-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]-4-nitrobenzamide
CID 56559110
4-[(4-methylphenyl)sulfamoyl]-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56557769
5-(tert-butylsulfamoyl)-2-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56556234
N-(4-methylphenyl)-N'-[4-(4-methylpiperidin-1-yl)phenyl]oxamide
CID 108986754
N-[4-(3-methylpyrrolidin-1-yl)phenyl]-4-(phenylcarbamoylamino)benzamide
CID 56556326
3,4,5-trimethoxy-N-[4-(3-methylpyrrolidin-1-yl)phenyl]-2-nitrobenzamide
CID 56556324
3-bromo-5-fluoro-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide
CID 56556215

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide?
The IUPAC name of 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide (CID 56559329) is 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide is Cc1ccc(O)c(C(=O)Nc2ccc(N3CCC(C)C3)cc2)c1.
What is the InChIKey of 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide?
The InChIKey is FJKGWFPPRVMYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-3-8-18(22)17(11-13)19(23)20-15-4-6-16(7-5-15)21-10-9-14(2)12-21/h3-8,11,14,22H,9-10,12H2,1-2H3,(H,20,23).
What are the key properties of 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide?
2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methyl-N-[4-(3-methylpyrrolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 56559329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).