N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide

C20H19N5O — CID 135344663

IUPACN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)C3CC34CC4)ncc2c(N)n1
InChIInChI=1S/C20H19N5O/c1-11-2-5-22-9-13(11)16-6-12-7-17(23-10-14(12)18(21)24-16)25-19(26)15-8-20(15)3-4-20/h2,5-7,9-10,15H,3-4,8H2,1H3,(H2,21,24)(H,23,25,26)
InChIKeyKDYAXURIILUJHR-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.32
Rot. Bonds3

About N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide

N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide (PubChem CID 135344663) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide.

Molecular Properties

Compound NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide
PubChem CID135344663
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)C3CC34CC4)ncc2c(N)n1
InChIInChI=1S/C20H19N5O/c1-11-2-5-22-9-13(11)16-6-12-7-17(23-10-14(12)18(21)24-16)25-19(26)15-8-20(15)3-4-20/h2,5-7,9-10,15H,3-4,8H2,1H3,(H2,21,24)(H,23,25,26)
InChIKeyKDYAXURIILUJHR-UHFFFAOYSA-N
XLogP3.32
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide?
The IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide (CID 135344663) is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide.
What is the SMILES notation for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide?
The canonical SMILES for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide is Cc1ccncc1-c1cc2cc(NC(=O)C3CC34CC4)ncc2c(N)n1.
What is the InChIKey of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide?
The InChIKey is KDYAXURIILUJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-11-2-5-22-9-13(11)16-6-12-7-17(23-10-14(12)18(21)24-16)25-19(26)15-8-20(15)3-4-20/h2,5-7,9-10,15H,3-4,8H2,1H3,(H2,21,24)(H,23,25,26).
What are the key properties of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide?
N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide has a molecular weight of 345.41 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]spiro[2.2]pentane-2-carboxamide is sourced from PubChem (CID 135344663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).