1-amino-2-pentyl(14C)guanidine

C6H16N4 — CID 100943751

IUPAC1-amino-2-pentyl(14C)guanidine
SMILESCCCCC/N=[14C](\N)NN
InChIInChI=1S/C6H16N4/c1-2-3-4-5-9-6(7)10-8/h2-5,8H2,1H3,(H3,7,9,10)/i6+2
InChIKeyMZEJHDCUHDWXSE-ZQBYOMGUSA-N
MW146.21 g/mol
LogP-0.05
Rot. Bonds4

About 1-amino-2-pentyl(14C)guanidine

1-amino-2-pentyl(14C)guanidine (PubChem CID 100943751) has the molecular formula C6H16N4 and a molecular weight of 146.21 g/mol. Its IUPAC name is 1-amino-2-pentyl(14C)guanidine.

Molecular Properties

Compound Name1-amino-2-pentyl(14C)guanidine
PubChem CID100943751
Molecular FormulaC6H16N4
Molecular Weight146.21 g/mol
Exact Mass146.14
IUPAC Name1-amino-2-pentyl(14C)guanidine
SMILESCCCCC/N=[14C](\N)NN
InChIInChI=1S/C6H16N4/c1-2-3-4-5-9-6(7)10-8/h2-5,8H2,1H3,(H3,7,9,10)/i6+2
InChIKeyMZEJHDCUHDWXSE-ZQBYOMGUSA-N
XLogP-0.05
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-amino-2-pentyl(14C)guanidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-pentyl(14C)guanidine?
The IUPAC name of 1-amino-2-pentyl(14C)guanidine (CID 100943751) is 1-amino-2-pentyl(14C)guanidine.
What is the SMILES notation for 1-amino-2-pentyl(14C)guanidine?
The canonical SMILES for 1-amino-2-pentyl(14C)guanidine is CCCCC/N=[14C](\N)NN.
What is the InChIKey of 1-amino-2-pentyl(14C)guanidine?
The InChIKey is MZEJHDCUHDWXSE-ZQBYOMGUSA-N. The full InChI is InChI=1S/C6H16N4/c1-2-3-4-5-9-6(7)10-8/h2-5,8H2,1H3,(H3,7,9,10)/i6+2.
What are the key properties of 1-amino-2-pentyl(14C)guanidine?
1-amino-2-pentyl(14C)guanidine has a molecular weight of 146.21 g/mol, XLogP of -0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-pentyl(14C)guanidine is sourced from PubChem (CID 100943751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).