2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide

C21H23N5O — CID 166309313

IUPAC2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
SMILESCC(NC(=O)CN1CCn2ccnc2C1)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C21H23N5O/c1-16(17-4-6-18(7-5-17)19-3-2-8-22-13-19)24-21(27)15-25-11-12-26-10-9-23-20(26)14-25/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27)
InChIKeySQIOMCMPHWEOOV-UHFFFAOYSA-N
MW361.45 g/mol
LogP2.64
Rot. Bonds5

About 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide (PubChem CID 166309313) has the molecular formula C21H23N5O and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
PubChem CID166309313
Molecular FormulaC21H23N5O
Molecular Weight361.45 g/mol
Exact Mass361.19
IUPAC Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
SMILESCC(NC(=O)CN1CCn2ccnc2C1)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C21H23N5O/c1-16(17-4-6-18(7-5-17)19-3-2-8-22-13-19)24-21(27)15-25-11-12-26-10-9-23-20(26)14-25/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27)
InChIKeySQIOMCMPHWEOOV-UHFFFAOYSA-N
XLogP2.64
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(1-benzofuran-2-yl)ethyl]-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)acetamide
CID 86774712
2-(methylamino)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
CID 120704866
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(4-propan-2-ylphenyl)ethanone
CID 63026239
2-(4-acetylpiperazin-1-yl)-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide
CID 40813283
N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide
CID 97334723
N-[1-(4-pyridin-3-ylphenyl)ethyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119897485
methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylpropanoate
CID 63014330
1-prop-2-ynyl-3-[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]urea
CID 96524118
1,5-dimethyl-N-[(1R)-1-(4-pyridin-3-ylphenyl)ethyl]pyrazole-4-carboxamide
CID 96567499
1-(3-hydroxypropyl)-3-[1-(4-pyridin-3-ylphenyl)ethyl]urea
CID 111619428
1-[(2S)-1-hydroxybutan-2-yl]-3-[(1R)-1-(4-pyridin-3-ylphenyl)ethyl]urea
CID 97096200
2-(1,4-diazepan-1-yl)-N-[(1R)-1-pyridin-3-ylethyl]acetamide
CID 81404554

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide?
The IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide (CID 166309313) is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide is CC(NC(=O)CN1CCn2ccnc2C1)c1ccc(-c2cccnc2)cc1.
What is the InChIKey of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide?
The InChIKey is SQIOMCMPHWEOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O/c1-16(17-4-6-18(7-5-17)19-3-2-8-22-13-19)24-21(27)15-25-11-12-26-10-9-23-20(26)14-25/h2-10,13,16H,11-12,14-15H2,1H3,(H,24,27).
What are the key properties of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide?
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide has a molecular weight of 361.45 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide is sourced from PubChem (CID 166309313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).