hydron;propane-1,3-diamine;iodide

C3H11IN2 — CID 175361100

IUPAChydron;propane-1,3-diamine;iodide
SMILESNCCCN.[H+].[I-]
InChIInChI=1S/C3H10N2.HI/c4-2-1-3-5;/h1-5H2;1H
InChIKeyUMDDLGMCNFAZDX-UHFFFAOYSA-N
MW202.04 g/mol
LogP-3.59
Rot. Bonds2

About hydron;propane-1,3-diamine;iodide

hydron;propane-1,3-diamine;iodide (PubChem CID 175361100) has the molecular formula C3H11IN2 and a molecular weight of 202.04 g/mol. Its IUPAC name is hydron;propane-1,3-diamine;iodide.

Molecular Properties

Compound Namehydron;propane-1,3-diamine;iodide
PubChem CID175361100
Molecular FormulaC3H11IN2
Molecular Weight202.04 g/mol
Exact Mass202.00
IUPAC Namehydron;propane-1,3-diamine;iodide
SMILESNCCCN.[H+].[I-]
InChIInChI=1S/C3H10N2.HI/c4-2-1-3-5;/h1-5H2;1H
InChIKeyUMDDLGMCNFAZDX-UHFFFAOYSA-N
XLogP-3.59
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.04
LogP ≤ 5-3.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

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CID 87378889
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Frequently Asked Questions

What is the IUPAC name of hydron;propane-1,3-diamine;iodide?
The IUPAC name of hydron;propane-1,3-diamine;iodide (CID 175361100) is hydron;propane-1,3-diamine;iodide.
What is the SMILES notation for hydron;propane-1,3-diamine;iodide?
The canonical SMILES for hydron;propane-1,3-diamine;iodide is NCCCN.[H+].[I-].
What is the InChIKey of hydron;propane-1,3-diamine;iodide?
The InChIKey is UMDDLGMCNFAZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2.HI/c4-2-1-3-5;/h1-5H2;1H.
What are the key properties of hydron;propane-1,3-diamine;iodide?
hydron;propane-1,3-diamine;iodide has a molecular weight of 202.04 g/mol, XLogP of -3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;propane-1,3-diamine;iodide is sourced from PubChem (CID 175361100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).