5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide

C18H23N5O2 — CID 56714336

IUPAC5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESO=C(NCc1ccccn1)c1cc2n(n1)CCN(CC1CCOC1)C2
InChIInChI=1S/C18H23N5O2/c24-18(20-10-15-3-1-2-5-19-15)17-9-16-12-22(6-7-23(16)21-17)11-14-4-8-25-13-14/h1-3,5,9,14H,4,6-8,10-13H2,(H,20,24)
InChIKeyWWSJEUJXEBEJIC-UHFFFAOYSA-N
MW341.42 g/mol
LogP1.06
Rot. Bonds5

About 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide

5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide (PubChem CID 56714336) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
PubChem CID56714336
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
SMILESO=C(NCc1ccccn1)c1cc2n(n1)CCN(CC1CCOC1)C2
InChIInChI=1S/C18H23N5O2/c24-18(20-10-15-3-1-2-5-19-15)17-9-16-12-22(6-7-23(16)21-17)11-14-4-8-25-13-14/h1-3,5,9,14H,4,6-8,10-13H2,(H,20,24)
InChIKeyWWSJEUJXEBEJIC-UHFFFAOYSA-N
XLogP1.06
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3,3-dimethylbutyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
CID 50957883
5-(1-ethylpiperidin-4-yl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
CID 56722158
(2S,3aR,7aR)-6-(oxan-4-ylmethyl)-N-(pyridin-2-ylmethyl)-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridine-2-carboxamide
CID 124783187
2-[(3R)-oxolan-3-yl]-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]ethanone
CID 126445697
1-cyclopentyl-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide
CID 35762704
6-methyl-2-morpholin-4-yl-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
CID 56731265
4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109212686
N-[(S)-[(3S)-1-[[(3S)-oxolan-3-yl]methyl]piperidin-3-yl]-pyridin-2-ylmethyl]cyclopropanecarboxamide
CID 92577175
4-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 47014446
4-piperidin-1-yl-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 109204576
(1R)-2-[(3R)-oxolan-3-yl]-1-phenyl-N-(pyridin-2-ylmethyl)ethanamine
CID 97241292
N-[4-(pyridin-2-ylmethylamino)phenyl]oxane-4-carboxamide
CID 112982951

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The IUPAC name of 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide (CID 56714336) is 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The canonical SMILES for 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide is O=C(NCc1ccccn1)c1cc2n(n1)CCN(CC1CCOC1)C2.
What is the InChIKey of 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
The InChIKey is WWSJEUJXEBEJIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c24-18(20-10-15-3-1-2-5-19-15)17-9-16-12-22(6-7-23(16)21-17)11-14-4-8-25-13-14/h1-3,5,9,14H,4,6-8,10-13H2,(H,20,24).
What are the key properties of 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide?
5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide has a molecular weight of 341.42 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-3-ylmethyl)-N-(pyridin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide is sourced from PubChem (CID 56714336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).