5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine

C26H24N4 — CID 168970909

IUPAC5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine
SMILESC=C1c2cncc(-c3ccccc3CC)c2C=CN1Cc1cn2cc(C)ccc2n1
InChIInChI=1S/C26H24N4/c1-4-20-7-5-6-8-22(20)25-14-27-13-24-19(3)29(12-11-23(24)25)16-21-17-30-15-18(2)9-10-26(30)28-21/h5-15,17H,3-4,16H2,1-2H3
InChIKeyXQETYTLSQUNIFG-UHFFFAOYSA-N
MW392.51 g/mol
LogP5.72
Rot. Bonds4

About 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine

5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine (PubChem CID 168970909) has the molecular formula C26H24N4 and a molecular weight of 392.51 g/mol. Its IUPAC name is 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine.

Molecular Properties

Compound Name5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine
PubChem CID168970909
Molecular FormulaC26H24N4
Molecular Weight392.51 g/mol
Exact Mass392.20
IUPAC Name5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine
SMILESC=C1c2cncc(-c3ccccc3CC)c2C=CN1Cc1cn2cc(C)ccc2n1
InChIInChI=1S/C26H24N4/c1-4-20-7-5-6-8-22(20)25-14-27-13-24-19(3)29(12-11-23(24)25)16-21-17-30-15-18(2)9-10-26(30)28-21/h5-15,17H,3-4,16H2,1-2H3
InChIKeyXQETYTLSQUNIFG-UHFFFAOYSA-N
XLogP5.72
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.51
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine?
The IUPAC name of 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine (CID 168970909) is 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine.
What is the SMILES notation for 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine?
The canonical SMILES for 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine is C=C1c2cncc(-c3ccccc3CC)c2C=CN1Cc1cn2cc(C)ccc2n1.
What is the InChIKey of 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine?
The InChIKey is XQETYTLSQUNIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4/c1-4-20-7-5-6-8-22(20)25-14-27-13-24-19(3)29(12-11-23(24)25)16-21-17-30-15-18(2)9-10-26(30)28-21/h5-15,17H,3-4,16H2,1-2H3.
What are the key properties of 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine?
5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine has a molecular weight of 392.51 g/mol, XLogP of 5.72, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylphenyl)-1-methylidene-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2,7-naphthyridine is sourced from PubChem (CID 168970909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).