7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C23H27N5O — CID 146072617

IUPAC7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCCCNC(=O)c1cn2c(n1)C(c1ccccc1)N(Cc1ccc(C)cn1)CC2
InChIInChI=1S/C23H27N5O/c1-3-11-24-23(29)20-16-28-13-12-27(15-19-10-9-17(2)14-25-19)21(22(28)26-20)18-7-5-4-6-8-18/h4-10,14,16,21H,3,11-13,15H2,1-2H3,(H,24,29)
InChIKeyGEZLKDCGRKLXRU-UHFFFAOYSA-N
MW389.50 g/mol
LogP3.33
Rot. Bonds6

About 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 146072617) has the molecular formula C23H27N5O and a molecular weight of 389.50 g/mol. Its IUPAC name is 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID146072617
Molecular FormulaC23H27N5O
Molecular Weight389.50 g/mol
Exact Mass389.22
IUPAC Name7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCCCNC(=O)c1cn2c(n1)C(c1ccccc1)N(Cc1ccc(C)cn1)CC2
InChIInChI=1S/C23H27N5O/c1-3-11-24-23(29)20-16-28-13-12-27(15-19-10-9-17(2)14-25-19)21(22(28)26-20)18-7-5-4-6-8-18/h4-10,14,16,21H,3,11-13,15H2,1-2H3,(H,24,29)
InChIKeyGEZLKDCGRKLXRU-UHFFFAOYSA-N
XLogP3.33
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 146072617) is 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CCCNC(=O)c1cn2c(n1)C(c1ccccc1)N(Cc1ccc(C)cn1)CC2.
What is the InChIKey of 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is GEZLKDCGRKLXRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O/c1-3-11-24-23(29)20-16-28-13-12-27(15-19-10-9-17(2)14-25-19)21(22(28)26-20)18-7-5-4-6-8-18/h4-10,14,16,21H,3,11-13,15H2,1-2H3,(H,24,29).
What are the key properties of 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 389.50 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(5-methyl-2-pyridinyl)methyl]-8-phenyl-N-propyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 146072617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).