1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one

C22H23N7O2 — CID 58379604

IUPAC1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N)nc5)nc4c32)CC1
InChIInChI=1S/C22H23N7O2/c1-13(30)28-9-7-15(8-10-28)29-21-18(27(2)22(29)31)12-24-17-5-4-16(26-20(17)21)14-3-6-19(23)25-11-14/h3-6,11-12,15H,7-10H2,1-2H3,(H2,23,25)
InChIKeyKARZWASGGWJISD-UHFFFAOYSA-N
MW417.47 g/mol
LogP2.11
Rot. Bonds2

About 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one

1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one (PubChem CID 58379604) has the molecular formula C22H23N7O2 and a molecular weight of 417.47 g/mol. Its IUPAC name is 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one.

Molecular Properties

Compound Name1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one
PubChem CID58379604
Molecular FormulaC22H23N7O2
Molecular Weight417.47 g/mol
Exact Mass417.19
IUPAC Name1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N)nc5)nc4c32)CC1
InChIInChI=1S/C22H23N7O2/c1-13(30)28-9-7-15(8-10-28)29-21-18(27(2)22(29)31)12-24-17-5-4-16(26-20(17)21)14-3-6-19(23)25-11-14/h3-6,11-12,15H,7-10H2,1-2H3,(H2,23,25)
InChIKeyKARZWASGGWJISD-UHFFFAOYSA-N
XLogP2.11
TPSA111.93 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one?
The IUPAC name of 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one (CID 58379604) is 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one.
What is the SMILES notation for 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one?
The canonical SMILES for 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one is CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N)nc5)nc4c32)CC1.
What is the InChIKey of 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one?
The InChIKey is KARZWASGGWJISD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N7O2/c1-13(30)28-9-7-15(8-10-28)29-21-18(27(2)22(29)31)12-24-17-5-4-16(26-20(17)21)14-3-6-19(23)25-11-14/h3-6,11-12,15H,7-10H2,1-2H3,(H2,23,25).
What are the key properties of 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one?
1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one has a molecular weight of 417.47 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpiperidin-4-yl)-8-(6-amino-3-pyridinyl)-3-methylimidazo[4,5-c][1,5]naphthyridin-2-one is sourced from PubChem (CID 58379604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).