(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide

C23H26FN3O2 — CID 125023854

IUPAC(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide
SMILESNC(=O)[C@]1(c2ccccn2)CCCN(C(=O)C2(c3ccccc3F)CCCC2)C1
InChIInChI=1S/C23H26FN3O2/c24-18-9-2-1-8-17(18)22(11-4-5-12-22)21(29)27-15-7-13-23(16-27,20(25)28)19-10-3-6-14-26-19/h1-3,6,8-10,14H,4-5,7,11-13,15-16H2,(H2,25,28)/t23-/m1/s1
InChIKeyZBGHBBIBNXIRDT-HSZRJFAPSA-N
MW395.48 g/mol
LogP3.08
Rot. Bonds4

About (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide

(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide (PubChem CID 125023854) has the molecular formula C23H26FN3O2 and a molecular weight of 395.48 g/mol. Its IUPAC name is (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide
PubChem CID125023854
Molecular FormulaC23H26FN3O2
Molecular Weight395.48 g/mol
Exact Mass395.20
IUPAC Name(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide
SMILESNC(=O)[C@]1(c2ccccn2)CCCN(C(=O)C2(c3ccccc3F)CCCC2)C1
InChIInChI=1S/C23H26FN3O2/c24-18-9-2-1-8-17(18)22(11-4-5-12-22)21(29)27-15-7-13-23(16-27,20(25)28)19-10-3-6-14-26-19/h1-3,6,8-10,14H,4-5,7,11-13,15-16H2,(H2,25,28)/t23-/m1/s1
InChIKeyZBGHBBIBNXIRDT-HSZRJFAPSA-N
XLogP3.08
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-[1-(4-methylphenyl)cyclohexanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide
CID 124953704
azepan-1-yl-[1-(2-fluorophenyl)cyclopentyl]methanone
CID 110436863
[1-(2-fluorophenyl)cyclopentyl]-[(3R)-3-hydroxy-3-(2H-triazol-4-yl)pyrrolidin-1-yl]methanone
CID 129486685
1-[1-(2-fluorophenyl)cyclobutanecarbonyl]piperidine-4-carboxamide
CID 110436587
[1-(2-fluorophenyl)cyclopropyl]-[(3R)-3-pyrimidin-4-ylpiperidin-1-yl]methanone
CID 124991616
1-[4-(3-fluorophenyl)oxane-4-carbonyl]-N-methyl-3-pyridin-2-ylpiperidine-3-carboxamide
CID 110148571
[1-(2-fluorophenyl)cyclobutyl]-(4-methylpiperidin-1-yl)methanone
CID 110436577
(3R)-1-(1-benzoyl-4-methylpiperidine-4-carbonyl)-N-methyl-3-pyridin-2-ylpiperidine-3-carboxamide
CID 124999862
3-pyridin-2-yl-1-[[2-(pyridin-2-ylmethoxy)phenyl]methyl]piperidine-3-carboxamide
CID 110149670
(5S)-2-[1-(2-fluorophenyl)cyclopropanecarbonyl]-7-propyl-2,7-diazaspiro[4.5]decan-6-one
CID 97147264
[1-(2-fluorophenyl)cyclopropyl]-[(3R)-3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone
CID 125003153
[1-(2-fluorophenyl)cyclobutyl]-(2-methylimidazol-1-yl)methanone
CID 110464622

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide?
The IUPAC name of (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide (CID 125023854) is (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide is NC(=O)[C@]1(c2ccccn2)CCCN(C(=O)C2(c3ccccc3F)CCCC2)C1.
What is the InChIKey of (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide?
The InChIKey is ZBGHBBIBNXIRDT-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H26FN3O2/c24-18-9-2-1-8-17(18)22(11-4-5-12-22)21(29)27-15-7-13-23(16-27,20(25)28)19-10-3-6-14-26-19/h1-3,6,8-10,14H,4-5,7,11-13,15-16H2,(H2,25,28)/t23-/m1/s1.
What are the key properties of (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide?
(3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide has a molecular weight of 395.48 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[1-(2-fluorophenyl)cyclopentanecarbonyl]-3-pyridin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 125023854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).