5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide

C16H23FN2O2 — CID 106625545

IUPAC5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide
SMILESCCCN(CC1CCCCN1)C(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H23FN2O2/c1-2-9-19(11-13-5-3-4-8-18-13)16(21)14-10-12(17)6-7-15(14)20/h6-7,10,13,18,20H,2-5,8-9,11H2,1H3
InChIKeyUHTLPSQIJVWUAF-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.53
Rot. Bonds5

About 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide

5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide (PubChem CID 106625545) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide
PubChem CID106625545
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide
SMILESCCCN(CC1CCCCN1)C(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H23FN2O2/c1-2-9-19(11-13-5-3-4-8-18-13)16(21)14-10-12(17)6-7-15(14)20/h6-7,10,13,18,20H,2-5,8-9,11H2,1H3
InChIKeyUHTLPSQIJVWUAF-UHFFFAOYSA-N
XLogP2.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-difluoro-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625849
2,4-dihydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625817
N-butyl-5-fluoro-2-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611857
N-ethyl-2-hydroxy-5-iodo-N-(piperidin-2-ylmethyl)benzamide
CID 107732253
2,4-dibromo-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 107940286
4-fluoro-2-hydroxy-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107016129
2-chloro-4-methyl-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106862424
4-fluoro-3-methyl-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625701
2-(3-fluorophenyl)-N-(piperidin-2-ylmethyl)-N-propylacetamide
CID 106625837
N-butyl-2-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612351
2,5-dihydroxy-N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107725339
3,4-difluoro-N-propyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106610422

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide (CID 106625545) is 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide is CCCN(CC1CCCCN1)C(=O)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide?
The InChIKey is UHTLPSQIJVWUAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-2-9-19(11-13-5-3-4-8-18-13)16(21)14-10-12(17)6-7-15(14)20/h6-7,10,13,18,20H,2-5,8-9,11H2,1H3.
What are the key properties of 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide?
5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide has a molecular weight of 294.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-(piperidin-2-ylmethyl)-N-propylbenzamide is sourced from PubChem (CID 106625545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).