2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide

C9H11N5O — CID 107545435

IUPAC2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nccc(C#N)n1
InChIInChI=1S/C9H11N5O/c1-2-14(6-8(11)15)9-12-4-3-7(5-10)13-9/h3-4H,2,6H2,1H3,(H2,11,15)
InChIKeyKUXNQOJUXDKELC-UHFFFAOYSA-N
MW205.22 g/mol
LogP-0.34
Rot. Bonds4

About 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide

2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide (PubChem CID 107545435) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide.

Molecular Properties

Compound Name2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide
PubChem CID107545435
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nccc(C#N)n1
InChIInChI=1S/C9H11N5O/c1-2-14(6-8(11)15)9-12-4-3-7(5-10)13-9/h3-4H,2,6H2,1H3,(H2,11,15)
InChIKeyKUXNQOJUXDKELC-UHFFFAOYSA-N
XLogP-0.34
TPSA95.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(4-cyanopyrimidin-2-yl)-ethylamino]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-[(4-cyanopyrimidin-2-yl)-ethylamino]acetic acid
CID 107542879
2-[(4-cyanopyrimidin-2-yl)-ethylamino]-N-propan-2-ylacetamide
CID 107544048
2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide
CID 103101208
2-[ethyl(2,2,2-trifluoroethyl)amino]pyrimidine-4-carbonitrile
CID 107544133
methyl 2-[(4-cyanopyrimidin-2-yl)-propylamino]acetate
CID 107544126
ethyl 2-[(4-cyanopyrimidin-2-yl)-methylamino]acetate
CID 107544034
2-[ethyl(pyridin-2-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 107544863
2-[bis(cyanomethyl)amino]pyrimidine-4-carbonitrile
CID 107543413
2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]pyrimidine-4-carbonitrile
CID 107544861
2-[(4-cyano-6-methylpyrimidin-2-yl)-(2-methylpropyl)amino]acetamide
CID 107544113
2-[bis(2-methoxyethyl)amino]pyrimidine-4-carbonitrile
CID 107543844
2-[(4-aminopyrimidin-2-yl)-butylamino]acetamide
CID 116796582

Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide?
The IUPAC name of 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide (CID 107545435) is 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide.
What is the SMILES notation for 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide?
The canonical SMILES for 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide is CCN(CC(N)=O)c1nccc(C#N)n1.
What is the InChIKey of 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide?
The InChIKey is KUXNQOJUXDKELC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-2-14(6-8(11)15)9-12-4-3-7(5-10)13-9/h3-4H,2,6H2,1H3,(H2,11,15).
What are the key properties of 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide?
2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide has a molecular weight of 205.22 g/mol, XLogP of -0.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide is sourced from PubChem (CID 107545435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).