N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide

C19H28FN3O2 — CID 24817570

IUPACN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide
SMILESCN(C(=O)CCN1CCCO1)C1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C19H28FN3O2/c1-21(19(24)9-12-23-11-5-13-25-23)17-7-4-10-22(15-17)14-16-6-2-3-8-18(16)20/h2-3,6,8,17H,4-5,7,9-15H2,1H3
InChIKeyDWIDSFMBEUKYRY-UHFFFAOYSA-N
MW349.45 g/mol
LogP2.28
Rot. Bonds6

About N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide

N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide (PubChem CID 24817570) 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]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide.

Molecular Properties

Compound NameN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide
PubChem CID24817570
Molecular FormulaC19H28FN3O2
Molecular Weight349.45 g/mol
Exact Mass349.22
IUPAC NameN-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide
SMILESCN(C(=O)CCN1CCCO1)C1CCCN(Cc2ccccc2F)C1
InChIInChI=1S/C19H28FN3O2/c1-21(19(24)9-12-23-11-5-13-25-23)17-7-4-10-22(15-17)14-16-6-2-3-8-18(16)20/h2-3,6,8,17H,4-5,7,9-15H2,1H3
InChIKeyDWIDSFMBEUKYRY-UHFFFAOYSA-N
XLogP2.28
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.45
LogP ≤ 52.28
H-Bond Donors ≤ 50
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]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide?
The IUPAC name of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide (CID 24817570) is N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide.
What is the SMILES notation for N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide?
The canonical SMILES for N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide is CN(C(=O)CCN1CCCO1)C1CCCN(Cc2ccccc2F)C1.
What is the InChIKey of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide?
The InChIKey is DWIDSFMBEUKYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FN3O2/c1-21(19(24)9-12-23-11-5-13-25-23)17-7-4-10-22(15-17)14-16-6-2-3-8-18(16)20/h2-3,6,8,17H,4-5,7,9-15H2,1H3.
What are the key properties of N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide?
N-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide has a molecular weight of 349.45 g/mol, XLogP of 2.28, 6 rotatable bonds, 0 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]-N-methyl-3-(1,2-oxazolidin-2-yl)propanamide is sourced from PubChem (CID 24817570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).