6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide

C17H18N6O3 — CID 126782285

IUPAC6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2nc[nH]c(=O)c2c1C(=O)NC1CCCN(c2cccnn2)C1
InChIInChI=1S/C17H18N6O3/c1-10-13(14-15(24)18-9-19-17(14)26-10)16(25)21-11-4-3-7-23(8-11)12-5-2-6-20-22-12/h2,5-6,9,11H,3-4,7-8H2,1H3,(H,21,25)(H,18,19,24)
InChIKeyJOKRROALWXQEHB-UHFFFAOYSA-N
MW354.37 g/mol
LogP1.01
Rot. Bonds3

About 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide

6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide (PubChem CID 126782285) has the molecular formula C17H18N6O3 and a molecular weight of 354.37 g/mol. Its IUPAC name is 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide
PubChem CID126782285
Molecular FormulaC17H18N6O3
Molecular Weight354.37 g/mol
Exact Mass354.14
IUPAC Name6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2nc[nH]c(=O)c2c1C(=O)NC1CCCN(c2cccnn2)C1
InChIInChI=1S/C17H18N6O3/c1-10-13(14-15(24)18-9-19-17(14)26-10)16(25)21-11-4-3-7-23(8-11)12-5-2-6-20-22-12/h2,5-6,9,11H,3-4,7-8H2,1H3,(H,21,25)(H,18,19,24)
InChIKeyJOKRROALWXQEHB-UHFFFAOYSA-N
XLogP1.01
TPSA117.01 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide with MolForge

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Related Compounds

3-acetyl-4-methyl-N-[(3S)-1-pyridazin-3-ylpiperidin-3-yl]benzamide
CID 124627039
methyl 5-[[(3S)-1-pyridazin-3-ylpiperidin-3-yl]carbamoyl]furan-3-carboxylate
CID 124616870
3-chloro-2-fluoro-4-methyl-N-[(3S)-1-pyridazin-3-ylpiperidin-3-yl]benzamide
CID 124886342
2-phenyl-N-[(3R)-1-pyridazin-3-ylpiperidin-3-yl]pyrazole-3-carboxamide
CID 124883211
6-methyl-2-(methylamino)-N-[(3R)-1-pyridazin-3-ylpiperidin-3-yl]pyrimidine-4-carboxamide
CID 124734406
N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxamide
CID 55946095
cis-(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[(3S)-1-pyridazin-3-ylpiperidin-3-yl]cyclopropane-1-carboxamide
CID 124859320
3-amino-N-(1-pyridazin-3-ylpiperidin-3-yl)butanamide;hydrochloride
CID 120872944
4-hydroxy-N-[(3S)-1-pyridazin-3-ylpiperidin-3-yl]naphthalene-2-carboxamide
CID 124882652
(3R)-N-(2-methylsulfonylethyl)-1-pyridazin-3-ylpiperidin-3-amine
CID 95331275
5-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]-6-methyl-3H-furo[2,3-d]pyrimidin-4-one
CID 79404295
3,5-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
CID 124573326

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide (CID 126782285) is 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide is Cc1oc2nc[nH]c(=O)c2c1C(=O)NC1CCCN(c2cccnn2)C1.
What is the InChIKey of 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is JOKRROALWXQEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O3/c1-10-13(14-15(24)18-9-19-17(14)26-10)16(25)21-11-4-3-7-23(8-11)12-5-2-6-20-22-12/h2,5-6,9,11H,3-4,7-8H2,1H3,(H,21,25)(H,18,19,24).
What are the key properties of 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide?
6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 354.37 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)-3H-furo[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 126782285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).