N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide

C14H16N4O2 — CID 96668386

IUPACN-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide
SMILESCOc1ccc(-c2nccnc2CN)cc1NC(C)=O
InChIInChI=1S/C14H16N4O2/c1-9(19)18-11-7-10(3-4-13(11)20-2)14-12(8-15)16-5-6-17-14/h3-7H,8,15H2,1-2H3,(H,18,19)
InChIKeyKSSSWSRPSLEFFW-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.57
Rot. Bonds4

About N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide

N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide (PubChem CID 96668386) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide
PubChem CID96668386
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide
SMILESCOc1ccc(-c2nccnc2CN)cc1NC(C)=O
InChIInChI=1S/C14H16N4O2/c1-9(19)18-11-7-10(3-4-13(11)20-2)14-12(8-15)16-5-6-17-14/h3-7H,8,15H2,1-2H3,(H,18,19)
InChIKeyKSSSWSRPSLEFFW-UHFFFAOYSA-N
XLogP1.57
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide 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-[5-(3-amino-1,2,4-triazin-5-yl)-2-methoxyphenyl]acetamide
CID 82483873
N-(5-iodo-2-methoxyphenyl)acetamide
CID 11737859
N-[5-[5-(aminomethyl)-1H-pyrazol-3-yl]-2-ethoxyphenyl]acetamide
CID 96669522
N-[2-methoxy-5-(methylamino)phenyl]acetamide
CID 82649039
N-(5-bromo-2-hydroxyphenyl)acetamide;N-(5-bromo-2-methoxyphenyl)acetamide
CID 121410401
N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide
CID 112514061
1-(2-methoxyphenyl)-3-[(3-thiophen-3-ylpyrazin-2-yl)methyl]urea
CID 122162320
2-methoxyethyl N-[2-methoxy-5-[5-(3,4,5-trimethoxyphenyl)-2H-triazol-4-yl]phenyl]carbamate
CID 59430320
N-(2,4,5-trimethoxyphenyl)acetamide
CID 54074808
N-[4-(2-ethylphenyl)-2-methoxyphenyl]acetamide
CID 56716418
N-[2,5-diethoxy-4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 1428113
N-[5-(3-amino-1H-pyrazol-5-yl)-2-ethoxyphenyl]acetamide
CID 82484529

Frequently Asked Questions

What is the IUPAC name of N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide?
The IUPAC name of N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide (CID 96668386) is N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide.
What is the SMILES notation for N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide?
The canonical SMILES for N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide is COc1ccc(-c2nccnc2CN)cc1NC(C)=O.
What is the InChIKey of N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide?
The InChIKey is KSSSWSRPSLEFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-9(19)18-11-7-10(3-4-13(11)20-2)14-12(8-15)16-5-6-17-14/h3-7H,8,15H2,1-2H3,(H,18,19).
What are the key properties of N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide?
N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide has a molecular weight of 272.31 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-(aminomethyl)pyrazin-2-yl]-2-methoxyphenyl]acetamide is sourced from PubChem (CID 96668386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).