N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide

C13H16FNO2 — CID 115298911

IUPACN-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(F)ccc1O)C1CC1
InChIInChI=1S/C13H16FNO2/c1-2-7-15(10-4-5-10)13(17)11-8-9(14)3-6-12(11)16/h3,6,8,10,16H,2,4-5,7H2,1H3
InChIKeyIGPJDXAVKUCZIK-UHFFFAOYSA-N
MW237.27 g/mol
LogP2.55
Rot. Bonds4

About N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide

N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide (PubChem CID 115298911) has the molecular formula C13H16FNO2 and a molecular weight of 237.27 g/mol. Its IUPAC name is N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide
PubChem CID115298911
Molecular FormulaC13H16FNO2
Molecular Weight237.27 g/mol
Exact Mass237.12
IUPAC NameN-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(F)ccc1O)C1CC1
InChIInChI=1S/C13H16FNO2/c1-2-7-15(10-4-5-10)13(17)11-8-9(14)3-6-12(11)16/h3,6,8,10,16H,2,4-5,7H2,1H3
InChIKeyIGPJDXAVKUCZIK-UHFFFAOYSA-N
XLogP2.55
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-cyclopropyl-5-fluoro-N-propylbenzamide
CID 43270647
N-cyclopentyl-5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 115298997
N-butyl-N-cyclopropyl-4-fluoro-2-hydroxybenzamide
CID 103887557
N-ethyl-5-fluoro-2-hydroxy-N-piperidin-4-ylbenzamide
CID 115299350
N-(4-aminocyclohexyl)-2-hydroxy-5-methyl-N-propylbenzamide
CID 79116898
N-butyl-N-cyclopropyl-2,5-dihydroxybenzamide
CID 103891986
2-amino-N-butyl-N-cyclopropyl-5-fluorobenzamide
CID 60944357
N-cyclopropyl-2,3-dihydroxy-N-propylbenzamide
CID 114343927
N-cyclopropyl-5-fluoro-N-(furan-2-ylmethyl)-2-hydroxybenzamide
CID 115299012
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63050163
2-hydroxy-5-iodo-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 107732095
N-(3-aminopropyl)-5-fluoro-2-hydroxy-N-propylbenzamide
CID 113281479

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide?
The IUPAC name of N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide (CID 115298911) is N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide.
What is the SMILES notation for N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide?
The canonical SMILES for N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide is CCCN(C(=O)c1cc(F)ccc1O)C1CC1.
What is the InChIKey of N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide?
The InChIKey is IGPJDXAVKUCZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FNO2/c1-2-7-15(10-4-5-10)13(17)11-8-9(14)3-6-12(11)16/h3,6,8,10,16H,2,4-5,7H2,1H3.
What are the key properties of N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide?
N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide has a molecular weight of 237.27 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-fluoro-2-hydroxy-N-propylbenzamide is sourced from PubChem (CID 115298911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).