N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

C21H30N4O3 — CID 71172025

IUPACN-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
SMILESCCCN1C(=O)c2cc(C(=O)CC3CC3)nn2CC1(C)C(=O)NC1CCCC1
InChIInChI=1S/C21H30N4O3/c1-3-10-24-19(27)17-12-16(18(26)11-14-8-9-14)23-25(17)13-21(24,2)20(28)22-15-6-4-5-7-15/h12,14-15H,3-11,13H2,1-2H3,(H,22,28)
InChIKeyYRHUAWWVSUPJQN-UHFFFAOYSA-N
MW386.50 g/mol
LogP2.55
Rot. Bonds7

About N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide (PubChem CID 71172025) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
PubChem CID71172025
Molecular FormulaC21H30N4O3
Molecular Weight386.50 g/mol
Exact Mass386.23
IUPAC NameN-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
SMILESCCCN1C(=O)c2cc(C(=O)CC3CC3)nn2CC1(C)C(=O)NC1CCCC1
InChIInChI=1S/C21H30N4O3/c1-3-10-24-19(27)17-12-16(18(26)11-14-8-9-14)23-25(17)13-21(24,2)20(28)22-15-6-4-5-7-15/h12,14-15H,3-11,13H2,1-2H3,(H,22,28)
InChIKeyYRHUAWWVSUPJQN-UHFFFAOYSA-N
XLogP2.55
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The IUPAC name of N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide (CID 71172025) is N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide is CCCN1C(=O)c2cc(C(=O)CC3CC3)nn2CC1(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The InChIKey is YRHUAWWVSUPJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c1-3-10-24-19(27)17-12-16(18(26)11-14-8-9-14)23-25(17)13-21(24,2)20(28)22-15-6-4-5-7-15/h12,14-15H,3-11,13H2,1-2H3,(H,22,28).
What are the key properties of N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2-cyclopropylacetyl)-6-methyl-4-oxo-5-propyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide is sourced from PubChem (CID 71172025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).