N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide

C19H25N7O — CID 172892297

IUPACN,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide
SMILESCc1cc2c(N3CCC(CN(C)C(=O)c4cnn(C)c4)CC3)nccn2n1
InChIInChI=1S/C19H25N7O/c1-14-10-17-18(20-6-9-26(17)22-14)25-7-4-15(5-8-25)12-23(2)19(27)16-11-21-24(3)13-16/h6,9-11,13,15H,4-5,7-8,12H2,1-3H3
InChIKeyCXBHSYAEORXTBN-UHFFFAOYSA-N
MW367.46 g/mol
LogP1.76
Rot. Bonds4

About N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide

N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide (PubChem CID 172892297) has the molecular formula C19H25N7O and a molecular weight of 367.46 g/mol. Its IUPAC name is N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide
PubChem CID172892297
Molecular FormulaC19H25N7O
Molecular Weight367.46 g/mol
Exact Mass367.21
IUPAC NameN,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide
SMILESCc1cc2c(N3CCC(CN(C)C(=O)c4cnn(C)c4)CC3)nccn2n1
InChIInChI=1S/C19H25N7O/c1-14-10-17-18(20-6-9-26(17)22-14)25-7-4-15(5-8-25)12-23(2)19(27)16-11-21-24(3)13-16/h6,9-11,13,15H,4-5,7-8,12H2,1-3H3
InChIKeyCXBHSYAEORXTBN-UHFFFAOYSA-N
XLogP1.76
TPSA71.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.46
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide?
The IUPAC name of N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide (CID 172892297) is N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide?
The canonical SMILES for N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide is Cc1cc2c(N3CCC(CN(C)C(=O)c4cnn(C)c4)CC3)nccn2n1.
What is the InChIKey of N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide?
The InChIKey is CXBHSYAEORXTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7O/c1-14-10-17-18(20-6-9-26(17)22-14)25-7-4-15(5-8-25)12-23(2)19(27)16-11-21-24(3)13-16/h6,9-11,13,15H,4-5,7-8,12H2,1-3H3.
What are the key properties of N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide?
N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide has a molecular weight of 367.46 g/mol, XLogP of 1.76, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 172892297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).