(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide

C19H21FN4O2 — CID 25346781

IUPAC(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide
SMILESNC(=O)NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H21FN4O2/c20-15-8-4-5-9-16(15)23-10-12-24(13-11-23)17(18(25)22-19(21)26)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H3,21,22,25,26)/t17-/m1/s1
InChIKeySUAUEFURIPIWDO-QGZVFWFLSA-N
MW356.40 g/mol
LogP1.88
Rot. Bonds4

About (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide

(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide (PubChem CID 25346781) has the molecular formula C19H21FN4O2 and a molecular weight of 356.40 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide
PubChem CID25346781
Molecular FormulaC19H21FN4O2
Molecular Weight356.40 g/mol
Exact Mass356.16
IUPAC Name(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide
SMILESNC(=O)NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H21FN4O2/c20-15-8-4-5-9-16(15)23-10-12-24(13-11-23)17(18(25)22-19(21)26)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H3,21,22,25,26)/t17-/m1/s1
InChIKeySUAUEFURIPIWDO-QGZVFWFLSA-N
XLogP1.88
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide?
The IUPAC name of (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide (CID 25346781) is (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide?
The canonical SMILES for (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide is NC(=O)NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccccc2F)CC1.
What is the InChIKey of (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide?
The InChIKey is SUAUEFURIPIWDO-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H21FN4O2/c20-15-8-4-5-9-16(15)23-10-12-24(13-11-23)17(18(25)22-19(21)26)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H3,21,22,25,26)/t17-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide?
(2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide has a molecular weight of 356.40 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 25346781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).