N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide

C24H23ClFN5O2 — CID 118935172

About N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide

N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 118935172) has the molecular formula C24H23ClFN5O2 and a molecular weight of 467.93 g/mol. Its IUPAC name is N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

• Compound Name: N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide
• PubChem CID: 118935172
• Molecular Formula: C24H23ClFN5O2
• Molecular Weight: 467.93 g/mol
• Exact Mass: 467.15
• IUPAC Name: N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide
• SMILES: NC(=O)C(c1ccccc1)N(C(=O)c1cnc2n1CCNC2)[C@@H]1CCc2c(F)cc(Cl)cc21
• InChI: InChI=1S/C24H23ClFN5O2/c25-15-10-17-16(18(26)11-15)6-7-19(17)31(22(23(27)32)14-4-2-1-3-5-14)24(33)20-12-29-21-13-28-8-9-30(20)21/h1-5,10-12,19,22,28H,6-9,13H2,(H2,27,32)/t19-,22?/m1/s1
• InChIKey: QENXTJVJNCLUTL-LCQOSCCDSA-N
• XLogP: 3.14
• TPSA: 93.25 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	467.93
LogP ≤ 5	3.14
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide?

The IUPAC name of N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide (CID 118935172) is N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide.

What is the SMILES notation for N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide?

The canonical SMILES for N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide is NC(=O)C(c1ccccc1)N(C(=O)c1cnc2n1CCNC2)[C@@H]1CCc2c(F)cc(Cl)cc21.

What is the InChIKey of N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide?

The InChIKey is QENXTJVJNCLUTL-LCQOSCCDSA-N. The full InChI is InChI=1S/C24H23ClFN5O2/c25-15-10-17-16(18(26)11-15)6-7-19(17)31(22(23(27)32)14-4-2-1-3-5-14)24(33)20-12-29-21-13-28-8-9-30(20)21/h1-5,10-12,19,22,28H,6-9,13H2,(H2,27,32)/t19-,22?/m1/s1.

What are the key properties of N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide?

N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 467.93 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-amino-2-oxo-1-phenylethyl)-N-[(1R)-6-chloro-4-fluoro-2,3-dihydro-1H-inden-1-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 118935172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).