5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

C19H25N7O — CID 138045424

IUPAC5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc2c(NCC3CCn4ncc(C(=O)NC(C)C)c4C3)nccn2n1
InChIInChI=1S/C19H25N7O/c1-12(2)23-19(27)15-11-22-25-6-4-14(9-16(15)25)10-21-18-17-8-13(3)24-26(17)7-5-20-18/h5,7-8,11-12,14H,4,6,9-10H2,1-3H3,(H,20,21)(H,23,27)
InChIKeyCEPZRSPLIQAJNG-UHFFFAOYSA-N
MW367.46 g/mol
LogP2.05
Rot. Bonds5

About 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide

5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 138045424) has the molecular formula C19H25N7O and a molecular weight of 367.46 g/mol. Its IUPAC name is 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID138045424
Molecular FormulaC19H25N7O
Molecular Weight367.46 g/mol
Exact Mass367.21
IUPAC Name5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc2c(NCC3CCn4ncc(C(=O)NC(C)C)c4C3)nccn2n1
InChIInChI=1S/C19H25N7O/c1-12(2)23-19(27)15-11-22-25-6-4-14(9-16(15)25)10-21-18-17-8-13(3)24-26(17)7-5-20-18/h5,7-8,11-12,14H,4,6,9-10H2,1-3H3,(H,20,21)(H,23,27)
InChIKeyCEPZRSPLIQAJNG-UHFFFAOYSA-N
XLogP2.05
TPSA89.14 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.46
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide (CID 138045424) is 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide is Cc1cc2c(NCC3CCn4ncc(C(=O)NC(C)C)c4C3)nccn2n1.
What is the InChIKey of 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is CEPZRSPLIQAJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7O/c1-12(2)23-19(27)15-11-22-25-6-4-14(9-16(15)25)10-21-18-17-8-13(3)24-26(17)7-5-20-18/h5,7-8,11-12,14H,4,6,9-10H2,1-3H3,(H,20,21)(H,23,27).
What are the key properties of 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide?
5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 367.46 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2-methylpyrazolo[1,5-a]pyrazin-4-yl)amino]methyl]-N-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 138045424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).