1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide

C24H29N7O — CID 162726130

IUPAC1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)C)CCN(c2ccc(-c3nc(C)cn4ncc(C#N)c34)cn2)CC1
InChIInChI=1S/C24H29N7O/c1-5-24(23(32)28-16(2)3)8-10-30(11-9-24)20-7-6-18(13-26-20)21-22-19(12-25)14-27-31(22)15-17(4)29-21/h6-7,13-16H,5,8-11H2,1-4H3,(H,28,32)
InChIKeyHLXRIYCOPRRSGI-UHFFFAOYSA-N
MW431.54 g/mol
LogP3.49
Rot. Bonds5

About 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide

1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 162726130) has the molecular formula C24H29N7O and a molecular weight of 431.54 g/mol. Its IUPAC name is 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID162726130
Molecular FormulaC24H29N7O
Molecular Weight431.54 g/mol
Exact Mass431.24
IUPAC Name1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)C)CCN(c2ccc(-c3nc(C)cn4ncc(C#N)c34)cn2)CC1
InChIInChI=1S/C24H29N7O/c1-5-24(23(32)28-16(2)3)8-10-30(11-9-24)20-7-6-18(13-26-20)21-22-19(12-25)14-27-31(22)15-17(4)29-21/h6-7,13-16H,5,8-11H2,1-4H3,(H,28,32)
InChIKeyHLXRIYCOPRRSGI-UHFFFAOYSA-N
XLogP3.49
TPSA99.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.54
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
CID 126740062
6-methyl-4-[6-[4-(3-methylbutanoyl)piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 162725896
1-[5-[3-cyano-6-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-(4-fluorophenyl)piperidine-4-carboxamide
CID 168856886
1-[5-[3-cyano-6-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-(oxan-4-yl)piperidine-4-carboxamide
CID 168856879
1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-4-ethyl-N-(2-methylpropyl)piperidine-4-carboxamide
CID 134436096
6-methyl-4-(6-piperazin-1-yl-3-pyridinyl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 162725441
1-[5-[3-cyano-6-[1-(4-formylcyclohexyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-N-cyclobutyl-4-ethylpiperidine-4-carboxamide
CID 162726100
1-[5-[3-cyano-6-[4-[4-[2-[1-[3-(2,4-dioxo-1,3-diazinan-1-yl)-1-methylindazol-6-yl]-4-hydroxypiperidin-4-yl]acetyl]piperazin-1-yl]phenyl]pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
CID 162725915
1-[5-[3-cyano-6-[1-[4-[4-[4-[[(3R)-2,6-dioxopiperidin-3-yl]amino]-2-fluorophenyl]piperidin-1-yl]cyclohexyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide;formic acid
CID 175717895
1-[5-(3-cyano-6-ethoxypyrazolo[1,5-a]pyridin-4-yl)-2-pyridinyl]-4-ethyl-N-(3-prop-1-en-2-ylphenyl)piperidine-4-carboxamide
CID 146667039
1-[5-[3-cyano-6-[1-[1-[2-[4-[4-[(2,6-dioxopiperidin-3-yl)amino]-2-fluorophenyl]piperidin-1-yl]acetyl]piperidin-4-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
CID 168856920
1-[5-[3-cyano-6-[1-[1-[2-[3-[4-[(2,6-dioxopiperidin-3-yl)amino]-2-fluorophenyl]-8-azabicyclo[3.2.1]octan-8-yl]acetyl]piperidin-4-yl]pyrazol-4-yl]pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
CID 162726018

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide (CID 162726130) is 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide is CCC1(C(=O)NC(C)C)CCN(c2ccc(-c3nc(C)cn4ncc(C#N)c34)cn2)CC1.
What is the InChIKey of 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is HLXRIYCOPRRSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N7O/c1-5-24(23(32)28-16(2)3)8-10-30(11-9-24)20-7-6-18(13-26-20)21-22-19(12-25)14-27-31(22)15-17(4)29-21/h6-7,13-16H,5,8-11H2,1-4H3,(H,28,32).
What are the key properties of 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide?
1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 431.54 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-cyano-6-methylpyrazolo[1,5-a]pyrazin-4-yl)-2-pyridinyl]-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 162726130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).