N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide

C20H16ClN3O — CID 123290807

IUPACN-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide
SMILESC=Cc1ccc(Cl)c(-c2cnc3cc(NC(=O)C4CC4)ncc3c2)c1
InChIInChI=1S/C20H16ClN3O/c1-2-12-3-6-17(21)16(7-12)14-8-15-11-23-19(9-18(15)22-10-14)24-20(25)13-4-5-13/h2-3,6-11,13H,1,4-5H2,(H,23,24,25)
InChIKeyLTECNIQZRLUFHN-UHFFFAOYSA-N
MW349.82 g/mol
LogP4.94
Rot. Bonds4

About N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide

N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide (PubChem CID 123290807) has the molecular formula C20H16ClN3O and a molecular weight of 349.82 g/mol. Its IUPAC name is N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide
PubChem CID123290807
Molecular FormulaC20H16ClN3O
Molecular Weight349.82 g/mol
Exact Mass349.10
IUPAC NameN-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide
SMILESC=Cc1ccc(Cl)c(-c2cnc3cc(NC(=O)C4CC4)ncc3c2)c1
InChIInChI=1S/C20H16ClN3O/c1-2-12-3-6-17(21)16(7-12)14-8-15-11-23-19(9-18(15)22-10-14)24-20(25)13-4-5-13/h2-3,6-11,13H,1,4-5H2,(H,23,24,25)
InChIKeyLTECNIQZRLUFHN-UHFFFAOYSA-N
XLogP4.94
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.82
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-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-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamide
CID 67975011
N-[6-(3,4-dichloroanilino)pyridazin-3-yl]cyclopropanecarboxamide
CID 113050746
N-[7-(6-formyl-4-methyl-3-pyridinyl)isoquinolin-3-yl]cyclopropanecarboxamide
CID 86674946
N-[3-[3-(cyclopropanecarbonylamino)isoquinolin-7-yl]-4-methylphenyl]cyclobutanecarboxamide
CID 57411211
N-[7-(2-amino-4-methylpyrimidin-5-yl)isoquinolin-3-yl]cyclopropanecarboxamide
CID 71115252
N-[6-(2,5-dichloroanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113022258
N-[7-(1H-indazol-6-yl)isoquinolin-3-yl]cyclopropanecarboxamide
CID 57410850
N-[4-chloro-3-[7-(methylamino)-1,6-naphthyridin-3-yl]phenyl]-4-(2-cyanopropan-2-yl)pyridine-2-carboxamide
CID 167511512
N-[5-(2,6-dichloroanilino)-2-pyridinyl]cyclopropanecarboxamide
CID 113036819
(3R)-1-tert-butyl-N-[5-chloro-4-(1H-pyrrolo[3,2-b]pyridin-6-yl)-2-pyridinyl]piperidine-3-carboxamide
CID 141418264
2-[4-[(dimethylamino)methyl]phenyl]-N-[7-(5-ethenyl-2-methylphenyl)isoquinolin-3-yl]cyclopropane-1-carboxamide
CID 123733243
N-[7-[4-(hydroxymethyl)-3-pyridinyl]isoquinolin-3-yl]cyclopropanecarboxamide
CID 57411093

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide?
The IUPAC name of N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide (CID 123290807) is N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide is C=Cc1ccc(Cl)c(-c2cnc3cc(NC(=O)C4CC4)ncc3c2)c1.
What is the InChIKey of N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide?
The InChIKey is LTECNIQZRLUFHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O/c1-2-12-3-6-17(21)16(7-12)14-8-15-11-23-19(9-18(15)22-10-14)24-20(25)13-4-5-13/h2-3,6-11,13H,1,4-5H2,(H,23,24,25).
What are the key properties of N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide?
N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide has a molecular weight of 349.82 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-chloro-5-ethenylphenyl)-1,6-naphthyridin-7-yl]cyclopropanecarboxamide is sourced from PubChem (CID 123290807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).