4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide

C15H23FN2O2 — CID 97340435

IUPAC4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide
SMILESCC[C@](C)(CCO)NC(=O)c1ccc(N(C)C)cc1F
InChIInChI=1S/C15H23FN2O2/c1-5-15(2,8-9-19)17-14(20)12-7-6-11(18(3)4)10-13(12)16/h6-7,10,19H,5,8-9H2,1-4H3,(H,17,20)/t15-/m1/s1
InChIKeyRSCNSEUXSGJFEA-OAHLLOKOSA-N
MW282.36 g/mol
LogP2.17
Rot. Bonds6

About 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide

4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide (PubChem CID 97340435) has the molecular formula C15H23FN2O2 and a molecular weight of 282.36 g/mol. Its IUPAC name is 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide
PubChem CID97340435
Molecular FormulaC15H23FN2O2
Molecular Weight282.36 g/mol
Exact Mass282.17
IUPAC Name4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide
SMILESCC[C@](C)(CCO)NC(=O)c1ccc(N(C)C)cc1F
InChIInChI=1S/C15H23FN2O2/c1-5-15(2,8-9-19)17-14(20)12-7-6-11(18(3)4)10-13(12)16/h6-7,10,19H,5,8-9H2,1-4H3,(H,17,20)/t15-/m1/s1
InChIKeyRSCNSEUXSGJFEA-OAHLLOKOSA-N
XLogP2.17
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-2-fluoro-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 110002687
2,4,5-trifluoro-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 110002324
2-fluoro-N-(1-hydroxy-3-methylpentan-3-yl)-4-nitrobenzamide
CID 103945514
2,4-difluoro-N-(1-hydroxy-3-methylpentan-3-yl)-5-methylbenzamide
CID 103945944
3,4-difluoro-N-(1-hydroxy-3-methylpentan-3-yl)benzamide
CID 113356518
N-(1-chloro-3-methylpentan-3-yl)-2-fluoro-4-hydroxybenzamide
CID 106168256
4-bromo-N-(1-bromo-3-methylpentan-3-yl)-2-fluorobenzamide
CID 106169569
4-chloro-2-fluoro-N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)benzamide
CID 110003172
4-(dimethylamino)-2-fluoro-N-[(2R)-1-hydroxybutan-2-yl]benzamide
CID 97340290
N-(2-cyano-1-methoxypropan-2-yl)-4-(dimethylamino)-2-fluorobenzamide
CID 75431578
2-fluoro-4-methoxy-N-(3-methylpentan-3-yl)benzamide
CID 113235181
2-bromo-N-(1-hydroxy-3-methylpentan-3-yl)-5-iodobenzamide
CID 113368412

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide?
The IUPAC name of 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide (CID 97340435) is 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide?
The canonical SMILES for 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide is CC[C@](C)(CCO)NC(=O)c1ccc(N(C)C)cc1F.
What is the InChIKey of 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide?
The InChIKey is RSCNSEUXSGJFEA-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H23FN2O2/c1-5-15(2,8-9-19)17-14(20)12-7-6-11(18(3)4)10-13(12)16/h6-7,10,19H,5,8-9H2,1-4H3,(H,17,20)/t15-/m1/s1.
What are the key properties of 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide?
4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide has a molecular weight of 282.36 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-2-fluoro-N-[(3R)-1-hydroxy-3-methylpentan-3-yl]benzamide is sourced from PubChem (CID 97340435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).