1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide

C20H17N7O3 — CID 166780718

IUPAC1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
SMILESCn1cc(-c2cc(Oc3ccc(NC(=O)c4cncn(C)c4=O)nc3)ccn2)cn1
InChIInChI=1S/C20H17N7O3/c1-26-12-21-10-16(20(26)29)19(28)25-18-4-3-15(9-23-18)30-14-5-6-22-17(7-14)13-8-24-27(2)11-13/h3-12H,1-2H3,(H,23,25,28)
InChIKeyRIUXSJDQHFRFRU-UHFFFAOYSA-N
MW403.40 g/mol
LogP2.02
Rot. Bonds5

About 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide

1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide (PubChem CID 166780718) has the molecular formula C20H17N7O3 and a molecular weight of 403.40 g/mol. Its IUPAC name is 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
PubChem CID166780718
Molecular FormulaC20H17N7O3
Molecular Weight403.40 g/mol
Exact Mass403.14
IUPAC Name1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
SMILESCn1cc(-c2cc(Oc3ccc(NC(=O)c4cncn(C)c4=O)nc3)ccn2)cn1
InChIInChI=1S/C20H17N7O3/c1-26-12-21-10-16(20(26)29)19(28)25-18-4-3-15(9-23-18)30-14-5-6-22-17(7-14)13-8-24-27(2)11-13/h3-12H,1-2H3,(H,23,25,28)
InChIKeyRIUXSJDQHFRFRU-UHFFFAOYSA-N
XLogP2.02
TPSA116.82 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

6-amino-1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxopyridine-3-carboxamide
CID 159854481
2-cyclopropyl-1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
CID 166780701
3-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxoimidazolidine-1-carboxamide
CID 86268217
2,2-dimethyl-N-[[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]propanamide
CID 86268065
8-acetyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-1-oxo-2,8-diazaspiro[4.5]decane-2-carboxamide
CID 146267954
N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-1,7-dioxo-2-azaspiro[4.5]decane-2-carboxamide
CID 146268035
3-(4-fluorophenyl)-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxoimidazolidine-1-carboxamide
CID 90446506
N-[5-[[2-(1-methyl-1,2,4-triazol-3-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxo-1-propan-2-ylpyridine-3-carboxamide
CID 166780519
ethane;N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3-(oxan-4-yl)-2-oxoimidazolidine-1-carboxamide;molecular hydrogen
CID 144709837
1,2-dimethyl-N-[5-[[2-(5-methylfuran-2-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
CID 166780664
N-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]acetamide
CID 90403222
N-[3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]phenyl]naphthalene-1-carboxamide
CID 23649066

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide?
The IUPAC name of 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide (CID 166780718) is 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide.
What is the SMILES notation for 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide?
The canonical SMILES for 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide is Cn1cc(-c2cc(Oc3ccc(NC(=O)c4cncn(C)c4=O)nc3)ccn2)cn1.
What is the InChIKey of 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide?
The InChIKey is RIUXSJDQHFRFRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7O3/c1-26-12-21-10-16(20(26)29)19(28)25-18-4-3-15(9-23-18)30-14-5-6-22-17(7-14)13-8-24-27(2)11-13/h3-12H,1-2H3,(H,23,25,28).
What are the key properties of 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide?
1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide has a molecular weight of 403.40 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide is sourced from PubChem (CID 166780718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).