(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide

C20H21FN2O2 — CID 94082579

IUPAC(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide
SMILESCc1cccc(C(=O)N2CCC[C@@H](C(=O)Nc3cccc(F)c3)C2)c1
InChIInChI=1S/C20H21FN2O2/c1-14-5-2-6-15(11-14)20(25)23-10-4-7-16(13-23)19(24)22-18-9-3-8-17(21)12-18/h2-3,5-6,8-9,11-12,16H,4,7,10,13H2,1H3,(H,22,24)/t16-/m1/s1
InChIKeyJFWVAGJSKSTVKY-MRXNPFEDSA-N
MW340.40 g/mol
LogP3.63
Rot. Bonds3

About (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide

(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide (PubChem CID 94082579) has the molecular formula C20H21FN2O2 and a molecular weight of 340.40 g/mol. Its IUPAC name is (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide
PubChem CID94082579
Molecular FormulaC20H21FN2O2
Molecular Weight340.40 g/mol
Exact Mass340.16
IUPAC Name(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide
SMILESCc1cccc(C(=O)N2CCC[C@@H](C(=O)Nc3cccc(F)c3)C2)c1
InChIInChI=1S/C20H21FN2O2/c1-14-5-2-6-15(11-14)20(25)23-10-4-7-16(13-23)19(24)22-18-9-3-8-17(21)12-18/h2-3,5-6,8-9,11-12,16H,4,7,10,13H2,1H3,(H,22,24)/t16-/m1/s1
InChIKeyJFWVAGJSKSTVKY-MRXNPFEDSA-N
XLogP3.63
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113008221
(3S)-N-(4-ethylphenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide
CID 94082527
(3S)-1-acetyl-N-(3-fluorophenyl)piperidine-3-carboxamide
CID 9068167
(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
CID 41091330
(3S)-1-acetyl-N-(3-methylphenyl)piperidine-3-carboxamide
CID 9039260
(4-fluorophenyl)-[1-(3-methylbenzoyl)piperidin-3-yl]methanone
CID 110394780
N-cyclohexyl-1-(3-methylbenzoyl)piperidine-3-carboxamide
CID 50803988
(3R)-1-[3-(trifluoromethyl)benzoyl]-N-[3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 94082199
(3R)-1-(3-methylbenzoyl)piperidine-3-carboxylic acid
CID 42257324
N-[4-(3-fluorophenyl)phenyl]-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 45208634
1-(3-acetamidobenzoyl)-N-(4-chlorophenyl)piperidine-3-carboxamide
CID 71681887
3-N-(3-acetamidophenyl)-1-N-(3-methylphenyl)piperidine-1,3-dicarboxamide
CID 55817615

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide (CID 94082579) is (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide is Cc1cccc(C(=O)N2CCC[C@@H](C(=O)Nc3cccc(F)c3)C2)c1.
What is the InChIKey of (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide?
The InChIKey is JFWVAGJSKSTVKY-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H21FN2O2/c1-14-5-2-6-15(11-14)20(25)23-10-4-7-16(13-23)19(24)22-18-9-3-8-17(21)12-18/h2-3,5-6,8-9,11-12,16H,4,7,10,13H2,1H3,(H,22,24)/t16-/m1/s1.
What are the key properties of (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide?
(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide has a molecular weight of 340.40 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 94082579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).