N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide

C14H13N5O — CID 62671468

IUPACN-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide
SMILESN#Cc1nccnc1NCC(=O)NCc1ccccc1
InChIInChI=1S/C14H13N5O/c15-8-12-14(17-7-6-16-12)19-10-13(20)18-9-11-4-2-1-3-5-11/h1-7H,9-10H2,(H,17,19)(H,18,20)
InChIKeyIZTYVRBVTQGLBE-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.08
Rot. Bonds5

About N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide

N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide (PubChem CID 62671468) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide
PubChem CID62671468
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide
SMILESN#Cc1nccnc1NCC(=O)NCc1ccccc1
InChIInChI=1S/C14H13N5O/c15-8-12-14(17-7-6-16-12)19-10-13(20)18-9-11-4-2-1-3-5-11/h1-7H,9-10H2,(H,17,19)(H,18,20)
InChIKeyIZTYVRBVTQGLBE-UHFFFAOYSA-N
XLogP1.08
TPSA90.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]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

2-[[2-[(3-cyanopyrazin-2-yl)amino]acetyl]amino]acetic acid
CID 55104822
N-benzyl-3-[(3-cyano-2-pyridinyl)amino]propanamide
CID 133279511
N-benzyl-2-[(4-chloro-1,2,5-thiadiazol-3-yl)amino]acetamide
CID 106193043
N-benzyl-2-(pyrazin-2-ylmethylamino)acetamide
CID 62763065
2-[(3-cyanopyrazin-2-yl)amino]ethylurea
CID 78993991
N-benzyl-2-[(6-chloro-5-formylpyrimidin-4-yl)amino]acetamide
CID 106193036
N-benzyl-2-[(2-cyanophenyl)sulfonylamino]acetamide
CID 8713182
N-benzyl-2-hydrazinylacetamide
CID 15514349
N-[4-[[(3-cyanopyrazin-2-yl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 133284759
N-benzyl-2-(2,4,6-trichloroanilino)acetamide
CID 28992616
2-[[2-(benzylamino)-2-oxoethyl]amino]-N-(2-cyanoethyl)acetamide
CID 60972076
2-[[2-[(4-cyanopyridazin-3-yl)amino]acetyl]amino]acetic acid
CID 80507919

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide?
The IUPAC name of N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide (CID 62671468) is N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide.
What is the SMILES notation for N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide?
The canonical SMILES for N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide is N#Cc1nccnc1NCC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide?
The InChIKey is IZTYVRBVTQGLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c15-8-12-14(17-7-6-16-12)19-10-13(20)18-9-11-4-2-1-3-5-11/h1-7H,9-10H2,(H,17,19)(H,18,20).
What are the key properties of N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide?
N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide has a molecular weight of 267.29 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[(3-cyanopyrazin-2-yl)amino]acetamide is sourced from PubChem (CID 62671468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).