2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide

C21H33N7O — CID 146114407

IUPAC2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
SMILESCCCn1nccc1NC(=O)CN1CCC(c2nc(C)n3c2CN(C)CC3)CC1
InChIInChI=1S/C21H33N7O/c1-4-9-28-19(5-8-22-28)24-20(29)15-26-10-6-17(7-11-26)21-18-14-25(3)12-13-27(18)16(2)23-21/h5,8,17H,4,6-7,9-15H2,1-3H3,(H,24,29)
InChIKeyDCUVUYFRPJYLQW-UHFFFAOYSA-N
MW399.54 g/mol
LogP2.06
Rot. Bonds6

About 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide

2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide (PubChem CID 146114407) has the molecular formula C21H33N7O and a molecular weight of 399.54 g/mol. Its IUPAC name is 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
PubChem CID146114407
Molecular FormulaC21H33N7O
Molecular Weight399.54 g/mol
Exact Mass399.27
IUPAC Name2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
SMILESCCCn1nccc1NC(=O)CN1CCC(c2nc(C)n3c2CN(C)CC3)CC1
InChIInChI=1S/C21H33N7O/c1-4-9-28-19(5-8-22-28)24-20(29)15-26-10-6-17(7-11-26)21-18-14-25(3)12-13-27(18)16(2)23-21/h5,8,17H,4,6-7,9-15H2,1-3H3,(H,24,29)
InChIKeyDCUVUYFRPJYLQW-UHFFFAOYSA-N
XLogP2.06
TPSA71.22 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.54
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide with MolForge

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Launch Full Analysis

Related Compounds

2-[(2R)-2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]-N-(2-propylpyrazol-3-yl)acetamide
CID 98153752
2-[(3R)-4-[(2R)-2-hydroxypropyl]-3-methylpiperazin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
CID 98148838
2-[(3S)-3-ethyl-4-[(2R)-2-hydroxypropyl]piperazin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
CID 100839085
1-[2-[[2-[(3-methylphenyl)methyl]pyrazol-3-yl]amino]-2-oxoethyl]piperidine-4-carboxylic acid
CID 119906680
2-(2-methoxyethylamino)-N-(2-propylpyrazol-3-yl)acetamide;hydrochloride
CID 119719149
N-(2-propylpyrazol-3-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxamide
CID 127447830
N-[2-(cyclohexylmethyl)pyrazol-3-yl]-2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 60507692
(1R)-N-(2-propylpyrazol-3-yl)cyclohex-3-ene-1-carboxamide
CID 38995892
ethyl 1-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 8772836
2-[cyclohexyl(2-hydroxyethyl)amino]-N-(2-propylpyrazol-3-yl)acetamide
CID 111461985
2-piperidin-1-yl-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 18155912
2-[2-hydroxyethyl(methyl)amino]-N-(2-propylpyrazol-3-yl)acetamide
CID 111123044

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide?
The IUPAC name of 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide (CID 146114407) is 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide is CCCn1nccc1NC(=O)CN1CCC(c2nc(C)n3c2CN(C)CC3)CC1.
What is the InChIKey of 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide?
The InChIKey is DCUVUYFRPJYLQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N7O/c1-4-9-28-19(5-8-22-28)24-20(29)15-26-10-6-17(7-11-26)21-18-14-25(3)12-13-27(18)16(2)23-21/h5,8,17H,4,6-7,9-15H2,1-3H3,(H,24,29).
What are the key properties of 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide?
2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide has a molecular weight of 399.54 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3,7-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl)piperidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide is sourced from PubChem (CID 146114407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).