2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide

C10H13N5O — CID 103101208

IUPAC2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nccc(C#N)c1N
InChIInChI=1S/C10H13N5O/c1-2-15(6-8(12)16)10-9(13)7(5-11)3-4-14-10/h3-4H,2,6,13H2,1H3,(H2,12,16)
InChIKeyLXDGBJWMPINZLN-UHFFFAOYSA-N
MW219.25 g/mol
LogP-0.15
Rot. Bonds4

About 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide

2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide (PubChem CID 103101208) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide.

Molecular Properties

Compound Name2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide
PubChem CID103101208
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nccc(C#N)c1N
InChIInChI=1S/C10H13N5O/c1-2-15(6-8(12)16)10-9(13)7(5-11)3-4-14-10/h3-4H,2,6,13H2,1H3,(H2,12,16)
InChIKeyLXDGBJWMPINZLN-UHFFFAOYSA-N
XLogP-0.15
TPSA109.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-amino-4-cyano-2-pyridinyl)-butylamino]acetamide
CID 82817305
2-[(3-amino-4-cyano-2-pyridinyl)-propylamino]-N-methylacetamide
CID 82817459
2-[(4-cyanopyrimidin-2-yl)-ethylamino]acetamide
CID 107545435
3-amino-2-[ethyl(thiophen-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 82817692
2-[(3-chloro-4-cyano-2-pyridinyl)-methylamino]acetamide
CID 107056929
2-[(4-aminophenyl)methyl-(4-cyanopyridazin-3-yl)amino]acetamide
CID 80515581
3-amino-2-[bis(cyclopropylmethyl)amino]pyridine-4-carbonitrile
CID 82813472
3-amino-2-[methyl(pentan-3-yl)amino]pyridine-4-carbonitrile
CID 82817290
2-[(5-amino-6-chloropyrimidin-4-yl)-ethylamino]acetamide
CID 103101135
2-(4-bromo-2-cyano-N-ethylanilino)acetamide
CID 103102407
2-[(4-cyanopyridazin-3-yl)-ethylamino]-N,N-dimethylacetamide
CID 80510309
2-[(3-carbamothioylpyrazin-2-yl)-ethylamino]acetamide
CID 103102572

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide?
The IUPAC name of 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide (CID 103101208) is 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide.
What is the SMILES notation for 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide?
The canonical SMILES for 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide is CCN(CC(N)=O)c1nccc(C#N)c1N.
What is the InChIKey of 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide?
The InChIKey is LXDGBJWMPINZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-2-15(6-8(12)16)10-9(13)7(5-11)3-4-14-10/h3-4H,2,6,13H2,1H3,(H2,12,16).
What are the key properties of 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide?
2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide has a molecular weight of 219.25 g/mol, XLogP of -0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-cyano-2-pyridinyl)-ethylamino]acetamide is sourced from PubChem (CID 103101208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).