N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide

C20H16N4O2 — CID 177212890

IUPACN-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ncc(C#Cc2ccc(O)cn2)c2cc(NC(=O)C3CC3)ncc12
InChIInChI=1S/C20H16N4O2/c1-12-18-11-23-19(24-20(26)13-2-3-13)8-17(18)14(9-21-12)4-5-15-6-7-16(25)10-22-15/h6-11,13,25H,2-3H2,1H3,(H,23,24,26)
InChIKeyZWDZZFLXHYGAAR-UHFFFAOYSA-N
MW344.37 g/mol
LogP2.79
Rot. Bonds2

About N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide

N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide (PubChem CID 177212890) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
PubChem CID177212890
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC NameN-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
SMILESCc1ncc(C#Cc2ccc(O)cn2)c2cc(NC(=O)C3CC3)ncc12
InChIInChI=1S/C20H16N4O2/c1-12-18-11-23-19(24-20(26)13-2-3-13)8-17(18)14(9-21-12)4-5-15-6-7-16(25)10-22-15/h6-11,13,25H,2-3H2,1H3,(H,23,24,26)
InChIKeyZWDZZFLXHYGAAR-UHFFFAOYSA-N
XLogP2.79
TPSA88.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-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

Related Compounds

N-[8-methyl-5-[2-[5-(methylamino)-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 177212968
N-[8-methyl-5-[2-[5-[(5R)-8-oxo-2,6-dioxa-9-azaspiro[4.5]decan-9-yl]-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 177212732
N-[8-methyl-5-[2-[5-[(5S)-8-oxo-2,6-dioxa-9-azaspiro[4.5]decan-9-yl]-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 177212893
N-[5-[2-[5-(difluoromethyl)-2-pyridinyl]ethynyl]-8-(methylamino)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 170677537
N-[5-[2-[5-(1-cyanoethyl)-2-pyridinyl]ethynyl]-8-(methylamino)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178122011
N-[5-[2-[5-(difluoromethoxy)-2-pyridinyl]ethynyl]-8-(methylamino)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 170678144
N-[5-[2-[5-(3-fluoroazetidin-1-yl)-2-pyridinyl]ethynyl]-8-(methylamino)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178121927
N-[8-(methylamino)-5-[2-(5-pyrazol-1-yl-2-pyridinyl)ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 170677939
cis-(1R,2R)-2-fluoro-N-[8-methyl-5-[2-(5-morpholin-4-yl-2-pyridinyl)ethynyl]-2,7-naphthyridin-3-yl]cyclopropane-1-carboxamide
CID 177212781
N-[8-methyl-5-[2-[4-morpholin-4-yl-5-[[(3S)-oxolan-3-yl]amino]-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 177212829
N-[8-(methylamino)-5-[2-[5-(1,2,4-triazol-4-ylmethyl)-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropanecarboxamide
CID 178121846
cis-(1S,2S)-2-fluoro-N-[8-methyl-5-[2-[5-[(2S)-2-methylmorpholin-4-yl]-2-pyridinyl]ethynyl]-2,7-naphthyridin-3-yl]cyclopropane-1-carboxamide
CID 177212466

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide (CID 177212890) is N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide is Cc1ncc(C#Cc2ccc(O)cn2)c2cc(NC(=O)C3CC3)ncc12.
What is the InChIKey of N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
The InChIKey is ZWDZZFLXHYGAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-12-18-11-23-19(24-20(26)13-2-3-13)8-17(18)14(9-21-12)4-5-15-6-7-16(25)10-22-15/h6-11,13,25H,2-3H2,1H3,(H,23,24,26).
What are the key properties of N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide?
N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide has a molecular weight of 344.37 g/mol, XLogP of 2.79, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(5-hydroxy-2-pyridinyl)ethynyl]-8-methyl-2,7-naphthyridin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 177212890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).