4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide

C20H17N5O2 — CID 122184275

IUPAC4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1
InChIInChI=1S/C20H17N5O2/c1-25-12-15(11-23-25)14-9-17-18(22-10-14)7-8-21-19(17)24-20(26)13-3-5-16(27-2)6-4-13/h3-12H,1-2H3,(H,21,24,26)
InChIKeyMBAQKGMTZDYDLU-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.29
Rot. Bonds4

About 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide

4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide (PubChem CID 122184275) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide
PubChem CID122184275
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1
InChIInChI=1S/C20H17N5O2/c1-25-12-15(11-23-25)14-9-17-18(22-10-14)7-8-21-19(17)24-20(26)13-3-5-16(27-2)6-4-13/h3-12H,1-2H3,(H,21,24,26)
InChIKeyMBAQKGMTZDYDLU-UHFFFAOYSA-N
XLogP3.29
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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Ssr161421
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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide?
The IUPAC name of 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide (CID 122184275) is 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide.
What is the SMILES notation for 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide?
The canonical SMILES for 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide is COc1ccc(C(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1.
What is the InChIKey of 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide?
The InChIKey is MBAQKGMTZDYDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c1-25-12-15(11-23-25)14-9-17-18(22-10-14)7-8-21-19(17)24-20(26)13-3-5-16(27-2)6-4-13/h3-12H,1-2H3,(H,21,24,26).
What are the key properties of 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide?
4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide has a molecular weight of 359.39 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzamide is sourced from PubChem (CID 122184275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).