[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone

C15H20N4O2 — CID 118744373

IUPAC[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone
SMILESCOCC1c2c(cnn2C)CCN1C(=O)c1cccn1C
InChIInChI=1S/C15H20N4O2/c1-17-7-4-5-12(17)15(20)19-8-6-11-9-16-18(2)14(11)13(19)10-21-3/h4-5,7,9,13H,6,8,10H2,1-3H3
InChIKeyAZIKRASDGUGLSA-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.14
Rot. Bonds3

About [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone

[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone (PubChem CID 118744373) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone.

Molecular Properties

Compound Name[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone
PubChem CID118744373
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone
SMILESCOCC1c2c(cnn2C)CCN1C(=O)c1cccn1C
InChIInChI=1S/C15H20N4O2/c1-17-7-4-5-12(17)15(20)19-8-6-11-9-16-18(2)14(11)13(19)10-21-3/h4-5,7,9,13H,6,8,10H2,1-3H3
InChIKeyAZIKRASDGUGLSA-UHFFFAOYSA-N
XLogP1.14
TPSA52.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone?
The IUPAC name of [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone (CID 118744373) is [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone.
What is the SMILES notation for [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone?
The canonical SMILES for [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone is COCC1c2c(cnn2C)CCN1C(=O)c1cccn1C.
What is the InChIKey of [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone?
The InChIKey is AZIKRASDGUGLSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-17-7-4-5-12(17)15(20)19-8-6-11-9-16-18(2)14(11)13(19)10-21-3/h4-5,7,9,13H,6,8,10H2,1-3H3.
What are the key properties of [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone?
[7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone has a molecular weight of 288.35 g/mol, XLogP of 1.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(1-methylpyrrol-2-yl)methanone is sourced from PubChem (CID 118744373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).