N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide

C26H24N4O3 — CID 162747313

IUPACN-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide
SMILESCCOc1ccccc1Oc1cccc(-c2cncc(NC(=O)CCc3ccccc3)n2)n1
InChIInChI=1S/C26H24N4O3/c1-2-32-22-12-6-7-13-23(22)33-26-14-8-11-20(29-26)21-17-27-18-24(28-21)30-25(31)16-15-19-9-4-3-5-10-19/h3-14,17-18H,2,15-16H2,1H3,(H,28,30,31)
InChIKeyGZHNMVRUIMHGOU-UHFFFAOYSA-N
MW440.50 g/mol
LogP5.30
Rot. Bonds9

About N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide

N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide (PubChem CID 162747313) has the molecular formula C26H24N4O3 and a molecular weight of 440.50 g/mol. Its IUPAC name is N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide
PubChem CID162747313
Molecular FormulaC26H24N4O3
Molecular Weight440.50 g/mol
Exact Mass440.18
IUPAC NameN-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide
SMILESCCOc1ccccc1Oc1cccc(-c2cncc(NC(=O)CCc3ccccc3)n2)n1
InChIInChI=1S/C26H24N4O3/c1-2-32-22-12-6-7-13-23(22)33-26-14-8-11-20(29-26)21-17-27-18-24(28-21)30-25(31)16-15-19-9-4-3-5-10-19/h3-14,17-18H,2,15-16H2,1H3,(H,28,30,31)
InChIKeyGZHNMVRUIMHGOU-UHFFFAOYSA-N
XLogP5.30
TPSA86.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.50
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide
CID 162747294
N-(2-ethoxyphenyl)-3-phenylpropanamide
CID 849126
N-[6-[3-(2-ethoxyphenoxy)phenyl]pyrazin-2-yl]-2-(4-ethylphenyl)acetamide
CID 170022142
N-[6-[5-(2-ethoxyphenoxy)-3-pyridinyl]pyrazin-2-yl]-2-(4-ethylphenyl)acetamide
CID 170022045
N-(6-chloropyrazin-2-yl)-3-phenylpropanamide
CID 115599331
2-[4-[3-[[6-[3-[(3-ethoxy-2-pyridinyl)oxy]phenyl]pyrazin-2-yl]amino]-3-oxopropyl]phenoxy]-2-methylpropanoic acid
CID 162747277
4-[[6-(2-ethoxyphenoxy)-3-pyridinyl]amino]-4-oxobutanoic acid
CID 39194137
N-(2-ethoxyphenyl)-4-(3-phenylpropanoylamino)benzamide
CID 1237348
4-[3-[[6-[(3R)-3-(2-ethoxyphenoxy)piperidin-1-yl]pyrazin-2-yl]amino]-3-oxopropyl]-2-methylbenzoic acid
CID 156541358
N-[2-(4-ethoxyphenoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 29224760
N-(2-ethoxyphenyl)-3-(1-phenylpyrazol-4-yl)propanamide
CID 26466144
2,2-dimethylpropane;3-phenyl-N-quinolin-3-ylpropanamide
CID 91168668

Frequently Asked Questions

What is the IUPAC name of N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide?
The IUPAC name of N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide (CID 162747313) is N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide.
What is the SMILES notation for N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide?
The canonical SMILES for N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide is CCOc1ccccc1Oc1cccc(-c2cncc(NC(=O)CCc3ccccc3)n2)n1.
What is the InChIKey of N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide?
The InChIKey is GZHNMVRUIMHGOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O3/c1-2-32-22-12-6-7-13-23(22)33-26-14-8-11-20(29-26)21-17-27-18-24(28-21)30-25(31)16-15-19-9-4-3-5-10-19/h3-14,17-18H,2,15-16H2,1H3,(H,28,30,31).
What are the key properties of N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide?
N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide has a molecular weight of 440.50 g/mol, XLogP of 5.30, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[6-(2-ethoxyphenoxy)-2-pyridinyl]pyrazin-2-yl]-3-phenylpropanamide is sourced from PubChem (CID 162747313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).