N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide

C19H28FN3O2 — CID 24793084

IUPACN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide
SMILESO=C(CCN1CCOCC1)NC1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C19H28FN3O2/c20-18-6-2-1-4-16(18)14-23-8-3-5-17(15-23)21-19(24)7-9-22-10-12-25-13-11-22/h1-2,4,6,17H,3,5,7-15H2,(H,21,24)
InChIKeyZCWAWSYNTZGIOQ-UHFFFAOYSA-N
MW349.45 g/mol
LogP1.63
Rot. Bonds6

About N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide

N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide (PubChem CID 24793084) has the molecular formula C19H28FN3O2 and a molecular weight of 349.45 g/mol. Its IUPAC name is N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide
PubChem CID24793084
Molecular FormulaC19H28FN3O2
Molecular Weight349.45 g/mol
Exact Mass349.22
IUPAC NameN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide
SMILESO=C(CCN1CCOCC1)NC1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C19H28FN3O2/c20-18-6-2-1-4-16(18)14-23-8-3-5-17(15-23)21-19(24)7-9-22-10-12-25-13-11-22/h1-2,4,6,17H,3,5,7-15H2,(H,21,24)
InChIKeyZCWAWSYNTZGIOQ-UHFFFAOYSA-N
XLogP1.63
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.45
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide?
The IUPAC name of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide (CID 24793084) is N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide is O=C(CCN1CCOCC1)NC1CCCN(Cc2ccccc2F)C1.
What is the InChIKey of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide?
The InChIKey is ZCWAWSYNTZGIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FN3O2/c20-18-6-2-1-4-16(18)14-23-8-3-5-17(15-23)21-19(24)7-9-22-10-12-25-13-11-22/h1-2,4,6,17H,3,5,7-15H2,(H,21,24).
What are the key properties of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide?
N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide has a molecular weight of 349.45 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 24793084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).