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

C7H13N7O — CID 83118066

IUPAC2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea
SMILESNNc1cc(NCCNC(N)=O)ncn1
InChIInChI=1S/C7H13N7O/c8-7(15)11-2-1-10-5-3-6(14-9)13-4-12-5/h3-4H,1-2,9H2,(H3,8,11,15)(H2,10,12,13,14)
InChIKeyWIFUTUFCPIVFAV-UHFFFAOYSA-N
MW211.23 g/mol
LogP-1.16
Rot. Bonds5

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

2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea (PubChem CID 83118066) has the molecular formula C7H13N7O and a molecular weight of 211.23 g/mol. Its IUPAC name is 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea.

Molecular Properties

Compound Name2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea
PubChem CID83118066
Molecular FormulaC7H13N7O
Molecular Weight211.23 g/mol
Exact Mass211.12
IUPAC Name2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea
SMILESNNc1cc(NCCNC(N)=O)ncn1
InChIInChI=1S/C7H13N7O/c8-7(15)11-2-1-10-5-3-6(14-9)13-4-12-5/h3-4H,1-2,9H2,(H3,8,11,15)(H2,10,12,13,14)
InChIKeyWIFUTUFCPIVFAV-UHFFFAOYSA-N
XLogP-1.16
TPSA130.98 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 5-1.16
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-[(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-[(6-methylpyrimidin-4-yl)amino]ethylurea
CID 79033984
2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethylurea
CID 83117256
2-(pyrimidin-4-ylamino)ethylurea
CID 83113277
2-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]ethylurea
CID 102721067
3-[[6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80786995
N-[2-[(6-aminopyrimidin-4-yl)amino]ethyl]acetamide
CID 79006981
5-[(6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138705
2-[[2-methyl-6-(propylamino)pyrimidin-4-yl]amino]ethylurea
CID 83117490
2-[(6-hydrazinylpyrimidin-4-yl)amino]-N,N-dimethylethanesulfonamide
CID 106341141
2-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]ethylurea
CID 83118223
methyl N-[2-[(6-methylpyrimidin-4-yl)amino]ethyl]carbamate
CID 90453684
2-[(6-amino-5-methoxypyrimidin-4-yl)amino]ethylurea
CID 83118452

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The IUPAC name of 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea (CID 83118066) is 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea.
What is the SMILES notation for 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The canonical SMILES for 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea is NNc1cc(NCCNC(N)=O)ncn1.
What is the InChIKey of 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
The InChIKey is WIFUTUFCPIVFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N7O/c8-7(15)11-2-1-10-5-3-6(14-9)13-4-12-5/h3-4H,1-2,9H2,(H3,8,11,15)(H2,10,12,13,14).
What are the key properties of 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea?
2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea has a molecular weight of 211.23 g/mol, XLogP of -1.16, 5 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinylpyrimidin-4-yl)amino]ethylurea is sourced from PubChem (CID 83118066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).