3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide

C17H19N5O3 — CID 121121318

IUPAC3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide
SMILESCOc1c2ccc(C(=O)NCCn3cncc(C)c3=O)cc2nn1C
InChIInChI=1S/C17H19N5O3/c1-11-9-18-10-22(16(11)24)7-6-19-15(23)12-4-5-13-14(8-12)20-21(2)17(13)25-3/h4-5,8-10H,6-7H2,1-3H3,(H,19,23)
InChIKeyQMFSGNBMTLYXHI-UHFFFAOYSA-N
MW341.37 g/mol
LogP0.88
Rot. Bonds5

About 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide

3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide (PubChem CID 121121318) has the molecular formula C17H19N5O3 and a molecular weight of 341.37 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide
PubChem CID121121318
Molecular FormulaC17H19N5O3
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC Name3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide
SMILESCOc1c2ccc(C(=O)NCCn3cncc(C)c3=O)cc2nn1C
InChIInChI=1S/C17H19N5O3/c1-11-9-18-10-22(16(11)24)7-6-19-15(23)12-4-5-13-14(8-12)20-21(2)17(13)25-3/h4-5,8-10H,6-7H2,1-3H3,(H,19,23)
InChIKeyQMFSGNBMTLYXHI-UHFFFAOYSA-N
XLogP0.88
TPSA91.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
CID 121121030
3-[[1-(3-methoxy-2-methylindazole-6-carbonyl)piperidin-4-yl]methyl]-5-methylpyrimidin-4-one
CID 126940655
3,4-diethoxy-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
CID 121121042
3-methoxy-2-methyl-N-(3-phenylpropyl)indazole-6-carboxamide
CID 90609146
2,5-dimethoxy-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
CID 121121150
N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]-4-nitrobenzamide
CID 121121235
N-[(2,6-difluorophenyl)methyl]-3-methoxy-2-methylindazole-6-carboxamide
CID 90609224
3-methoxy-N-(3-methylbutyl)-2-propylindazole-6-carboxamide
CID 71425614
N-[2-[2-(5-methyl-6-oxopyrimidin-1-yl)ethylamino]-2-oxoethyl]benzamide
CID 121121115
N-cycloheptyl-3-methoxy-2-methylindazole-6-carboxamide
CID 90609130
3-(4-methoxyphenyl)-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]propanamide
CID 121121097
2-fluoro-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
CID 121121043

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide?
The IUPAC name of 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide (CID 121121318) is 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide?
The canonical SMILES for 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide is COc1c2ccc(C(=O)NCCn3cncc(C)c3=O)cc2nn1C.
What is the InChIKey of 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide?
The InChIKey is QMFSGNBMTLYXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O3/c1-11-9-18-10-22(16(11)24)7-6-19-15(23)12-4-5-13-14(8-12)20-21(2)17(13)25-3/h4-5,8-10H,6-7H2,1-3H3,(H,19,23).
What are the key properties of 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide?
3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]indazole-6-carboxamide is sourced from PubChem (CID 121121318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).