N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide

C23H21N5O3 — CID 177186958

IUPACN-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ncc(-c2nc3cc(C4CCOC4)ncc3o2)c2cc(NC(=O)C3CC3)ncc12
InChIInChI=1S/C23H21N5O3/c1-12-16-8-26-21(28-22(29)13-2-3-13)6-15(16)17(9-24-12)23-27-19-7-18(14-4-5-30-11-14)25-10-20(19)31-23/h6-10,13-14H,2-5,11H2,1H3,(H,26,28,29)
InChIKeyBZTWDTUZSDRSFL-UHFFFAOYSA-N
MW415.45 g/mol
LogP3.99
Rot. Bonds4

About N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide

N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide (PubChem CID 177186958) has the molecular formula C23H21N5O3 and a molecular weight of 415.45 g/mol. Its IUPAC name is N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
PubChem CID177186958
Molecular FormulaC23H21N5O3
Molecular Weight415.45 g/mol
Exact Mass415.16
IUPAC NameN-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ncc(-c2nc3cc(C4CCOC4)ncc3o2)c2cc(NC(=O)C3CC3)ncc12
InChIInChI=1S/C23H21N5O3/c1-12-16-8-26-21(28-22(29)13-2-3-13)6-15(16)17(9-24-12)23-27-19-7-18(14-4-5-30-11-14)25-10-20(19)31-23/h6-10,13-14H,2-5,11H2,1H3,(H,26,28,29)
InChIKeyBZTWDTUZSDRSFL-UHFFFAOYSA-N
XLogP3.99
TPSA103.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.45
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide (CID 177186958) is N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide is Cc1ncc(-c2nc3cc(C4CCOC4)ncc3o2)c2cc(NC(=O)C3CC3)ncc12.
What is the InChIKey of N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The InChIKey is BZTWDTUZSDRSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O3/c1-12-16-8-26-21(28-22(29)13-2-3-13)6-15(16)17(9-24-12)23-27-19-7-18(14-4-5-30-11-14)25-10-20(19)31-23/h6-10,13-14H,2-5,11H2,1H3,(H,26,28,29).
What are the key properties of N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide has a molecular weight of 415.45 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-methyl-5-[6-(oxolan-3-yl)-[1,3]oxazolo[5,4-c]pyridin-2-yl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 177186958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).