2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea

C9H17N7O — CID 83117256

IUPAC2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea
SMILESCCc1nc(NN)cc(NCCNC(N)=O)n1
InChIInChI=1S/C9H17N7O/c1-2-6-14-7(5-8(15-6)16-11)12-3-4-13-9(10)17/h5H,2-4,11H2,1H3,(H3,10,13,17)(H2,12,14,15,16)
InChIKeyKNSGASLNCFHTAP-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.60
Rot. Bonds6

About 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea

2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea (PubChem CID 83117256) has the molecular formula C9H17N7O and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea.

Molecular Properties

Compound Name2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea
PubChem CID83117256
Molecular FormulaC9H17N7O
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea
SMILESCCc1nc(NN)cc(NCCNC(N)=O)n1
InChIInChI=1S/C9H17N7O/c1-2-6-14-7(5-8(15-6)16-11)12-3-4-13-9(10)17/h5H,2-4,11H2,1H3,(H3,10,13,17)(H2,12,14,15,16)
InChIKeyKNSGASLNCFHTAP-UHFFFAOYSA-N
XLogP-0.60
TPSA130.98 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.60
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea 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-ethyl-6-(methylamino)pyrimidin-4-yl]amino]ethylurea
CID 83118223
2-[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106242008
3-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-N-(2-methylpropyl)propanamide
CID 113411201
3-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80933202
2-[[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]ethylurea
CID 83117490
3-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
CID 80933122
2-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]ethylurea
CID 102721067
2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea
CID 83118066
2-[(6-amino-2-propylpyrimidin-4-yl)amino]ethylurea
CID 83118298
2-ethyl-6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrimidin-4-amine
CID 80937540
2-ethyl-6-hydrazinyl-N-[2-(2-methoxyethoxy)ethyl]pyrimidin-4-amine
CID 80938072
2-[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 80937148

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The IUPAC name of 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea (CID 83117256) is 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea.
What is the SMILES notation for 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The canonical SMILES for 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea is CCc1nc(NN)cc(NCCNC(N)=O)n1.
What is the InChIKey of 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The InChIKey is KNSGASLNCFHTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N7O/c1-2-6-14-7(5-8(15-6)16-11)12-3-4-13-9(10)17/h5H,2-4,11H2,1H3,(H3,10,13,17)(H2,12,14,15,16).
What are the key properties of 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea has a molecular weight of 239.28 g/mol, XLogP of -0.60, 6 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea is sourced from PubChem (CID 83117256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).