N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide

C21H19N5O — CID 118664686

IUPACN-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide
SMILESCC(=O)N(C)c1cncc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)c1
InChIInChI=1S/C21H19N5O/c1-14-5-4-6-21(24-14)26-20-10-16(7-8-17(20)12-23-26)18-9-19(13-22-11-18)25(3)15(2)27/h4-13H,1-3H3
InChIKeyZKYUQUULJBQEND-UHFFFAOYSA-N
MW357.42 g/mol
LogP3.77
Rot. Bonds3

About N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide

N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide (PubChem CID 118664686) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide
PubChem CID118664686
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC NameN-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide
SMILESCC(=O)N(C)c1cncc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)c1
InChIInChI=1S/C21H19N5O/c1-14-5-4-6-21(24-14)26-20-10-16(7-8-17(20)12-23-26)18-9-19(13-22-11-18)25(3)15(2)27/h4-13H,1-3H3
InChIKeyZKYUQUULJBQEND-UHFFFAOYSA-N
XLogP3.77
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide?
The IUPAC name of N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide (CID 118664686) is N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide.
What is the SMILES notation for N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide?
The canonical SMILES for N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide is CC(=O)N(C)c1cncc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)c1.
What is the InChIKey of N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide?
The InChIKey is ZKYUQUULJBQEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O/c1-14-5-4-6-21(24-14)26-20-10-16(7-8-17(20)12-23-26)18-9-19(13-22-11-18)25(3)15(2)27/h4-13H,1-3H3.
What are the key properties of N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide?
N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide has a molecular weight of 357.42 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3-pyridinyl]acetamide is sourced from PubChem (CID 118664686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).