(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide

C19H20FN3O2 — CID 9070375

IUPAC(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C19H20FN3O2/c20-15-8-10-17(11-9-15)21-18(24)14-5-4-12-23(13-14)19(25)22-16-6-2-1-3-7-16/h1-3,6-11,14H,4-5,12-13H2,(H,21,24)(H,22,25)/t14-/m0/s1
InChIKeyWFINIKBDKQKFMW-AWEZNQCLSA-N
MW341.39 g/mol
LogP3.71
Rot. Bonds3

About (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide

(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide (PubChem CID 9070375) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
PubChem CID9070375
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC Name(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C19H20FN3O2/c20-15-8-10-17(11-9-15)21-18(24)14-5-4-12-23(13-14)19(25)22-16-6-2-1-3-7-16/h1-3,6-11,14H,4-5,12-13H2,(H,21,24)(H,22,25)/t14-/m0/s1
InChIKeyWFINIKBDKQKFMW-AWEZNQCLSA-N
XLogP3.71
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-N-(4-chlorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9073266
(3S)-3-N-(4-methylphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9071786
(3S)-3-[[(4-fluorobenzoyl)amino]carbamoyl]-N-phenylpiperidine-1-carboxamide
CID 8870757
(3R)-3-N-benzyl-1-N-(4-fluorophenyl)piperidine-1,3-dicarboxamide
CID 51686692
(3R)-N-phenyl-1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-3-carboxamide
CID 34568694
(3R)-3-N-(2-ethylphenyl)-1-N-(4-fluorophenyl)piperidine-1,3-dicarboxamide
CID 51686700
(3S)-3-N-[4-(methylcarbamoyl)phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9091528
(3S)-1-N-(4-fluorophenyl)piperidine-1,3-dicarboxamide
CID 7333045
(3S)-3-N-phenyl-1-N-(1H-pyrazol-4-yl)piperidine-1,3-dicarboxamide
CID 95156850
1-N-phenyl-3-N-(4-propylphenyl)piperidine-1,3-dicarboxamide
CID 24503682
3-N-[4-(cyclopropylcarbamoyl)phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 55489108
(3S)-3-N-(4-ethoxyphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 7435320

Frequently Asked Questions

What is the IUPAC name of (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide?
The IUPAC name of (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide (CID 9070375) is (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide?
The canonical SMILES for (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide is O=C(Nc1ccc(F)cc1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1.
What is the InChIKey of (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide?
The InChIKey is WFINIKBDKQKFMW-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H20FN3O2/c20-15-8-10-17(11-9-15)21-18(24)14-5-4-12-23(13-14)19(25)22-16-6-2-1-3-7-16/h1-3,6-11,14H,4-5,12-13H2,(H,21,24)(H,22,25)/t14-/m0/s1.
What are the key properties of (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide?
(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide has a molecular weight of 341.39 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 9070375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).