N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide

C14H19FN2O2 — CID 103728822

IUPACN-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
SMILESCC1(O)CCN(CCC(=O)Nc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O2/c1-14(19)7-9-17(10-14)8-6-13(18)16-12-5-3-2-4-11(12)15/h2-5,19H,6-10H2,1H3,(H,16,18)
InChIKeyRVLWHGGRLQIMMS-UHFFFAOYSA-N
MW266.32 g/mol
LogP1.61
Rot. Bonds4

About N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide

N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide (PubChem CID 103728822) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
PubChem CID103728822
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
SMILESCC1(O)CCN(CCC(=O)Nc2ccccc2F)C1
InChIInChI=1S/C14H19FN2O2/c1-14(19)7-9-17(10-14)8-6-13(18)16-12-5-3-2-4-11(12)15/h2-5,19H,6-10H2,1H3,(H,16,18)
InChIKeyRVLWHGGRLQIMMS-UHFFFAOYSA-N
XLogP1.61
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide?
The IUPAC name of N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide (CID 103728822) is N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide?
The canonical SMILES for N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide is CC1(O)CCN(CCC(=O)Nc2ccccc2F)C1.
What is the InChIKey of N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide?
The InChIKey is RVLWHGGRLQIMMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-14(19)7-9-17(10-14)8-6-13(18)16-12-5-3-2-4-11(12)15/h2-5,19H,6-10H2,1H3,(H,16,18).
What are the key properties of N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide?
N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide has a molecular weight of 266.32 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide is sourced from PubChem (CID 103728822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).