3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide

C17H20N4O3 — CID 136529703

IUPAC3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)c2nccnc2C(N)=O)cc1
InChIInChI=1S/C17H20N4O3/c1-10(2)24-13-6-4-12(5-7-13)11(3)21-17(23)15-14(16(18)22)19-8-9-20-15/h4-11H,1-3H3,(H2,18,22)(H,21,23)
InChIKeyHZUKPYMZNCPRJV-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.85
Rot. Bonds6

About 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide

3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide (PubChem CID 136529703) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide.

Molecular Properties

Compound Name3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide
PubChem CID136529703
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)c2nccnc2C(N)=O)cc1
InChIInChI=1S/C17H20N4O3/c1-10(2)24-13-6-4-12(5-7-13)11(3)21-17(23)15-14(16(18)22)19-8-9-20-15/h4-11H,1-3H3,(H2,18,22)(H,21,23)
InChIKeyHZUKPYMZNCPRJV-UHFFFAOYSA-N
XLogP1.85
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide 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

2-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 43699540
2-amino-2-methyl-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 61264808
N-[1-(4-propan-2-yloxyphenyl)ethyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 112820551
1-(1-hydroxypropan-2-yl)-3-[1-(4-propan-2-yloxyphenyl)ethyl]urea
CID 110895700
3-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide;hydrochloride
CID 119285649
(2S)-2-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]butanamide;hydrochloride
CID 119285670
1-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119716690
2-amino-N-[2-oxo-2-[1-(4-propan-2-yloxyphenyl)ethylamino]ethyl]acetamide
CID 60846458
(2S,3S)-2-amino-3-methyl-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 61155475
3-amino-N-[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]pyrazine-2-carboxamide
CID 37354088
(2S)-2-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 107568369
5-chloro-N-[1-(4-propan-2-yloxyphenyl)ethyl]pentanamide
CID 43696732

Frequently Asked Questions

What is the IUPAC name of 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide?
The IUPAC name of 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide (CID 136529703) is 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide.
What is the SMILES notation for 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide?
The canonical SMILES for 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide is CC(C)Oc1ccc(C(C)NC(=O)c2nccnc2C(N)=O)cc1.
What is the InChIKey of 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide?
The InChIKey is HZUKPYMZNCPRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-10(2)24-13-6-4-12(5-7-13)11(3)21-17(23)15-14(16(18)22)19-8-9-20-15/h4-11H,1-3H3,(H2,18,22)(H,21,23).
What are the key properties of 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide?
3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[1-(4-propan-2-yloxyphenyl)ethyl]pyrazine-2,3-dicarboxamide is sourced from PubChem (CID 136529703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).