4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide

C13H17FN2O — CID 95031837

IUPAC4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide
SMILESCc1cc(C(=O)N[C@@H]2CCCNC2)ccc1F
InChIInChI=1S/C13H17FN2O/c1-9-7-10(4-5-12(9)14)13(17)16-11-3-2-6-15-8-11/h4-5,7,11,15H,2-3,6,8H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyFENHWVQRRDPGLL-LLVKDONJSA-N
MW236.29 g/mol
LogP1.62
Rot. Bonds2

About 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide

4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide (PubChem CID 95031837) has the molecular formula C13H17FN2O and a molecular weight of 236.29 g/mol. Its IUPAC name is 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide
PubChem CID95031837
Molecular FormulaC13H17FN2O
Molecular Weight236.29 g/mol
Exact Mass236.13
IUPAC Name4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide
SMILESCc1cc(C(=O)N[C@@H]2CCCNC2)ccc1F
InChIInChI=1S/C13H17FN2O/c1-9-7-10(4-5-12(9)14)13(17)16-11-3-2-6-15-8-11/h4-5,7,11,15H,2-3,6,8H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyFENHWVQRRDPGLL-LLVKDONJSA-N
XLogP1.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-3-methyl-N-[(3R)-piperidin-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

3-bromo-4-fluoro-N-[(3R)-piperidin-3-yl]benzamide
CID 99849634
3-chloro-4-methyl-N-[(3S)-piperidin-3-yl]benzamide
CID 113341605
3-chloro-4-methyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426938
4-amino-3-fluoro-N-[(3R)-piperidin-3-yl]benzamide
CID 89423886
N-(azepan-3-yl)-3-bromo-4-fluorobenzamide
CID 114020396
3-methyl-4-nitro-N-[(3S)-piperidin-3-yl]benzamide
CID 103866634
4-fluoro-2-methyl-N-[(3R)-piperidin-3-yl]benzamide
CID 113436694
3-fluoro-5-methyl-N-[(3S)-piperidin-3-yl]benzamide
CID 99618356
3,4,5-trifluoro-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429053
4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119450676
3-chloro-4-fluoro-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 82878959
3-[(4-bromobenzoyl)amino]-4-methyl-N-[(3S)-piperidin-3-yl]benzamide
CID 91646526

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide?
The IUPAC name of 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide (CID 95031837) is 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide.
What is the SMILES notation for 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide?
The canonical SMILES for 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide is Cc1cc(C(=O)N[C@@H]2CCCNC2)ccc1F.
What is the InChIKey of 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide?
The InChIKey is FENHWVQRRDPGLL-LLVKDONJSA-N. The full InChI is InChI=1S/C13H17FN2O/c1-9-7-10(4-5-12(9)14)13(17)16-11-3-2-6-15-8-11/h4-5,7,11,15H,2-3,6,8H2,1H3,(H,16,17)/t11-/m1/s1.
What are the key properties of 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide?
4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide has a molecular weight of 236.29 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-methyl-N-[(3R)-piperidin-3-yl]benzamide is sourced from PubChem (CID 95031837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).