2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide

C23H25N7O2 — CID 58379509

IUPAC2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide
SMILESCc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1
InChIInChI=1S/C23H25N7O2/c1-14-3-4-15(11-25-14)17-5-6-18-21(27-17)22-19(12-26-18)28(2)23(32)30(22)16-7-9-29(10-8-16)13-20(24)31/h3-6,11-12,16H,7-10,13H2,1-2H3,(H2,24,31)
InChIKeyYXFAAQVTSYIBFS-UHFFFAOYSA-N
MW431.50 g/mol
LogP1.78
Rot. Bonds4

About 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide

2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide (PubChem CID 58379509) has the molecular formula C23H25N7O2 and a molecular weight of 431.50 g/mol. Its IUPAC name is 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide
PubChem CID58379509
Molecular FormulaC23H25N7O2
Molecular Weight431.50 g/mol
Exact Mass431.21
IUPAC Name2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide
SMILESCc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1
InChIInChI=1S/C23H25N7O2/c1-14-3-4-15(11-25-14)17-5-6-18-21(27-17)22-19(12-26-18)28(2)23(32)30(22)16-7-9-29(10-8-16)13-20(24)31/h3-6,11-12,16H,7-10,13H2,1-2H3,(H2,24,31)
InChIKeyYXFAAQVTSYIBFS-UHFFFAOYSA-N
XLogP1.78
TPSA111.93 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide (CID 58379509) is 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide is Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1.
What is the InChIKey of 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide?
The InChIKey is YXFAAQVTSYIBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O2/c1-14-3-4-15(11-25-14)17-5-6-18-21(27-17)22-19(12-26-18)28(2)23(32)30(22)16-7-9-29(10-8-16)13-20(24)31/h3-6,11-12,16H,7-10,13H2,1-2H3,(H2,24,31).
What are the key properties of 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide?
2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide has a molecular weight of 431.50 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-methyl-8-(6-methyl-3-pyridinyl)-2-oxoimidazo[4,5-c][1,5]naphthyridin-1-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 58379509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).