2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide

C17H20N4O3 — CID 120787142

IUPAC2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide
SMILESNC(C(=O)Nc1cccc(Oc2cnccn2)c1)C1CCOCC1
InChIInChI=1S/C17H20N4O3/c18-16(12-4-8-23-9-5-12)17(22)21-13-2-1-3-14(10-13)24-15-11-19-6-7-20-15/h1-3,6-7,10-12,16H,4-5,8-9,18H2,(H,21,22)
InChIKeyIEGASPAUXHKZFM-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.96
Rot. Bonds5

About 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide

2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide (PubChem CID 120787142) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide
PubChem CID120787142
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide
SMILESNC(C(=O)Nc1cccc(Oc2cnccn2)c1)C1CCOCC1
InChIInChI=1S/C17H20N4O3/c18-16(12-4-8-23-9-5-12)17(22)21-13-2-1-3-14(10-13)24-15-11-19-6-7-20-15/h1-3,6-7,10-12,16H,4-5,8-9,18H2,(H,21,22)
InChIKeyIEGASPAUXHKZFM-UHFFFAOYSA-N
XLogP1.96
TPSA99.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-2-(oxan-4-yl)-N-(3-pyridazin-3-yloxyphenyl)acetamide;dihydrochloride
CID 120801133
2-amino-2-(oxan-4-yl)-N-(3-propoxyphenyl)acetamide;hydrochloride
CID 120786651
2-amino-N-[6-(4-methylphenoxy)-3-pyridinyl]-2-(oxan-4-yl)acetamide
CID 120798308
2-amino-N-(3-chlorophenyl)-2-(oxan-4-yl)acetamide
CID 120782718
2-amino-N-(3-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120782660
N-(3-acetamidophenyl)-2-amino-2-(oxan-4-yl)acetamide;hydrochloride
CID 120782773
N-(3-pyrazin-2-yloxyphenyl)morpholine-3-carboxamide
CID 119720300
2-amino-2-(oxan-4-yl)-N-[3-[2-(1,2,4-triazol-1-yl)ethoxy]phenyl]acetamide;dihydrochloride
CID 120798729
2-amino-N-[6-(4-methoxyphenoxy)-3-pyridinyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120801081
2-amino-2-(oxan-4-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 120784140
1-amino-N-(3-pyrazin-2-yloxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119287655
N-(3-pyrazin-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119287653

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide?
The IUPAC name of 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide (CID 120787142) is 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide is NC(C(=O)Nc1cccc(Oc2cnccn2)c1)C1CCOCC1.
What is the InChIKey of 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide?
The InChIKey is IEGASPAUXHKZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c18-16(12-4-8-23-9-5-12)17(22)21-13-2-1-3-14(10-13)24-15-11-19-6-7-20-15/h1-3,6-7,10-12,16H,4-5,8-9,18H2,(H,21,22).
What are the key properties of 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide?
2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide has a molecular weight of 328.37 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(oxan-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acetamide is sourced from PubChem (CID 120787142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).