N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide

C19H26FN3O3 — CID 53138078

IUPACN-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide
SMILESO=C(CCC1CCCN(C(=O)Nc2ccc(F)cc2)C1)N1CCOCC1
InChIInChI=1S/C19H26FN3O3/c20-16-4-6-17(7-5-16)21-19(25)23-9-1-2-15(14-23)3-8-18(24)22-10-12-26-13-11-22/h4-7,15H,1-3,8-14H2,(H,21,25)
InChIKeyIOLBPBFQLVDZED-UHFFFAOYSA-N
MW363.43 g/mol
LogP2.71
Rot. Bonds4

About N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide

N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide (PubChem CID 53138078) has the molecular formula C19H26FN3O3 and a molecular weight of 363.43 g/mol. Its IUPAC name is N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide
PubChem CID53138078
Molecular FormulaC19H26FN3O3
Molecular Weight363.43 g/mol
Exact Mass363.20
IUPAC NameN-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide
SMILESO=C(CCC1CCCN(C(=O)Nc2ccc(F)cc2)C1)N1CCOCC1
InChIInChI=1S/C19H26FN3O3/c20-16-4-6-17(7-5-16)21-19(25)23-9-1-2-15(14-23)3-8-18(24)22-10-12-26-13-11-22/h4-7,15H,1-3,8-14H2,(H,21,25)
InChIKeyIOLBPBFQLVDZED-UHFFFAOYSA-N
XLogP2.71
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.43
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide (CID 53138078) is N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide is O=C(CCC1CCCN(C(=O)Nc2ccc(F)cc2)C1)N1CCOCC1.
What is the InChIKey of N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide?
The InChIKey is IOLBPBFQLVDZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26FN3O3/c20-16-4-6-17(7-5-16)21-19(25)23-9-1-2-15(14-23)3-8-18(24)22-10-12-26-13-11-22/h4-7,15H,1-3,8-14H2,(H,21,25).
What are the key properties of N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide?
N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide has a molecular weight of 363.43 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-3-(3-morpholin-4-yl-3-oxopropyl)piperidine-1-carboxamide is sourced from PubChem (CID 53138078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).