3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide

C15H21NO2 — CID 103873764

IUPAC3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide
SMILESCCCC1(CNC(=O)c2cccc(O)c2C)CC1
InChIInChI=1S/C15H21NO2/c1-3-7-15(8-9-15)10-16-14(18)12-5-4-6-13(17)11(12)2/h4-6,17H,3,7-10H2,1-2H3,(H,16,18)
InChIKeyRJZHOUQVURGQLQ-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.01
Rot. Bonds5

About 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide

3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide (PubChem CID 103873764) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide.

Molecular Properties

Compound Name3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide
PubChem CID103873764
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide
SMILESCCCC1(CNC(=O)c2cccc(O)c2C)CC1
InChIInChI=1S/C15H21NO2/c1-3-7-15(8-9-15)10-16-14(18)12-5-4-6-13(17)11(12)2/h4-6,17H,3,7-10H2,1-2H3,(H,16,18)
InChIKeyRJZHOUQVURGQLQ-UHFFFAOYSA-N
XLogP3.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(bromomethyl)cyclopentyl]methyl]-3-hydroxy-2-methylbenzamide
CID 82830831
2-fluoro-3-methyl-N-[(1-propylcyclopropyl)methyl]benzamide
CID 113257623
3-hydroxy-2-methyl-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103873632
N-[[1-(chloromethyl)cyclohexyl]methyl]-3-hydroxy-2-methylbenzamide
CID 103969522
2-iodo-N-[(1-propylcyclopropyl)methyl]benzamide
CID 103762311
N-[(1-ethylcyclopropyl)methyl]-2,3-dihydroxybenzamide
CID 104931813
3-bromo-N-[[1-(2-bromoethyl)cyclopropyl]methyl]-2-methylbenzamide
CID 114758209
N-[[1-(2-bromoethyl)cyclopropyl]methyl]-3-chloro-2-methylbenzamide
CID 107100287
N-[(1-propylcyclopropyl)methyl]benzamide
CID 103762150
4-[[(3-hydroxy-2-methylbenzoyl)amino]methyl]oxane-4-carboxylic acid
CID 82809123
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-2-methylbenzamide
CID 114757948
N-[[1-(bromomethyl)cyclopropyl]methyl]-2,3-dihydroxybenzamide
CID 114345330

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide?
The IUPAC name of 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide (CID 103873764) is 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide.
What is the SMILES notation for 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide?
The canonical SMILES for 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide is CCCC1(CNC(=O)c2cccc(O)c2C)CC1.
What is the InChIKey of 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide?
The InChIKey is RJZHOUQVURGQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-7-15(8-9-15)10-16-14(18)12-5-4-6-13(17)11(12)2/h4-6,17H,3,7-10H2,1-2H3,(H,16,18).
What are the key properties of 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide?
3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide has a molecular weight of 247.34 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-N-[(1-propylcyclopropyl)methyl]benzamide is sourced from PubChem (CID 103873764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).