(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide

C23H24N6O2 — CID 139468767

IUPAC(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)[C@@H]3C[C@]34CCNC(=O)CC4)ncc2c(N)n1
InChIInChI=1S/C23H24N6O2/c1-13-3-6-25-11-15(13)18-8-14-9-19(27-12-16(14)21(24)28-18)29-22(31)17-10-23(17)4-2-20(30)26-7-5-23/h3,6,8-9,11-12,17H,2,4-5,7,10H2,1H3,(H2,24,28)(H,26,30)(H,27,29,31)/t17-,23-/m0/s1
InChIKeyUYGRAOBHEODYPB-SBUREZEXSA-N
MW416.49 g/mol
LogP2.83
Rot. Bonds3

About (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide

(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide (PubChem CID 139468767) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide
PubChem CID139468767
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)[C@@H]3C[C@]34CCNC(=O)CC4)ncc2c(N)n1
InChIInChI=1S/C23H24N6O2/c1-13-3-6-25-11-15(13)18-8-14-9-19(27-12-16(14)21(24)28-18)29-22(31)17-10-23(17)4-2-20(30)26-7-5-23/h3,6,8-9,11-12,17H,2,4-5,7,10H2,1H3,(H2,24,28)(H,26,30)(H,27,29,31)/t17-,23-/m0/s1
InChIKeyUYGRAOBHEODYPB-SBUREZEXSA-N
XLogP2.83
TPSA122.89 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 52.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide?
The IUPAC name of (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide (CID 139468767) is (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide.
What is the SMILES notation for (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide?
The canonical SMILES for (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide is Cc1ccncc1-c1cc2cc(NC(=O)[C@@H]3C[C@]34CCNC(=O)CC4)ncc2c(N)n1.
What is the InChIKey of (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide?
The InChIKey is UYGRAOBHEODYPB-SBUREZEXSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-13-3-6-25-11-15(13)18-8-14-9-19(27-12-16(14)21(24)28-18)29-22(31)17-10-23(17)4-2-20(30)26-7-5-23/h3,6,8-9,11-12,17H,2,4-5,7,10H2,1H3,(H2,24,28)(H,26,30)(H,27,29,31)/t17-,23-/m0/s1.
What are the key properties of (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide?
(2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide has a molecular weight of 416.49 g/mol, XLogP of 2.83, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-6-oxo-7-azaspiro[2.6]nonane-2-carboxamide is sourced from PubChem (CID 139468767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).