3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide

C15H22N2O2 — CID 82828949

IUPAC3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
SMILESCc1c(O)cccc1C(=O)NC(C)CN1CCCC1
InChIInChI=1S/C15H22N2O2/c1-11(10-17-8-3-4-9-17)16-15(19)13-6-5-7-14(18)12(13)2/h5-7,11,18H,3-4,8-10H2,1-2H3,(H,16,19)
InChIKeyBJNYIQAEGYZFNB-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.91
Rot. Bonds4

About 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide

3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide (PubChem CID 82828949) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
PubChem CID82828949
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
SMILESCc1c(O)cccc1C(=O)NC(C)CN1CCCC1
InChIInChI=1S/C15H22N2O2/c1-11(10-17-8-3-4-9-17)16-15(19)13-6-5-7-14(18)12(13)2/h5-7,11,18H,3-4,8-10H2,1-2H3,(H,16,19)
InChIKeyBJNYIQAEGYZFNB-UHFFFAOYSA-N
XLogP1.91
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 61217194
3-hydroxy-N-(4-hydroxybutan-2-yl)-2-methylbenzamide
CID 82839881
3-hydroxy-N-[(2R)-1-hydroxypropan-2-yl]-2-methylbenzamide
CID 82829211
3-hydroxy-N-(5-hydroxypentan-2-yl)-2-methylbenzamide
CID 82829372
5-chloro-2-hydroxy-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 61217192
2-methyl-3-[(3-methyl-1-piperidin-1-ylbutan-2-yl)carbamoyl]benzoic acid
CID 166290185
2-(propylamino)-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 62174346
2-hydroxy-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]benzamide
CID 47379683
2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-5-sulfanylbenzamide
CID 107025186
4-fluoro-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 112702718
N-(1-ethoxypropan-2-yl)-3-hydroxy-2-methylbenzamide
CID 82828956
2-hydrazinyl-5-methyl-N-(1-piperidin-1-ylpropan-2-yl)benzamide
CID 62511679

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The IUPAC name of 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide (CID 82828949) is 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide.
What is the SMILES notation for 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The canonical SMILES for 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide is Cc1c(O)cccc1C(=O)NC(C)CN1CCCC1.
What is the InChIKey of 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The InChIKey is BJNYIQAEGYZFNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(10-17-8-3-4-9-17)16-15(19)13-6-5-7-14(18)12(13)2/h5-7,11,18H,3-4,8-10H2,1-2H3,(H,16,19).
What are the key properties of 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide?
3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide has a molecular weight of 262.35 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide is sourced from PubChem (CID 82828949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).