azane;N'-propylethane-1,2-diamine

C5H17N3 — CID 87476258

IUPACazane;N'-propylethane-1,2-diamine
SMILESCCCNCCN.N
InChIInChI=1S/C5H14N2.H3N/c1-2-4-7-5-3-6;/h7H,2-6H2,1H3;1H3
InChIKeyRYZYAPBCOZVCBU-UHFFFAOYSA-N
MW119.21 g/mol
LogP0.11
Rot. Bonds4

About azane;N'-propylethane-1,2-diamine

azane;N'-propylethane-1,2-diamine (PubChem CID 87476258) has the molecular formula C5H17N3 and a molecular weight of 119.21 g/mol. Its IUPAC name is azane;N'-propylethane-1,2-diamine.

Molecular Properties

Compound Nameazane;N'-propylethane-1,2-diamine
PubChem CID87476258
Molecular FormulaC5H17N3
Molecular Weight119.21 g/mol
Exact Mass119.14
IUPAC Nameazane;N'-propylethane-1,2-diamine
SMILESCCCNCCN.N
InChIInChI=1S/C5H14N2.H3N/c1-2-4-7-5-3-6;/h7H,2-6H2,1H3;1H3
InChIKeyRYZYAPBCOZVCBU-UHFFFAOYSA-N
XLogP0.11
TPSA73.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.21
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze azane;N'-propylethane-1,2-diamine 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

cyclopropane;N'-propylethane-1,2-diamine
CID 175530712
formaldehyde;N'-[2-(propylamino)ethyl]ethane-1,2-diamine
CID 174938120
azane;N-propylpropan-1-amine;trihydrochloride
CID 173212322
N'-docosylethane-1,2-diamine
CID 18783196
N'-henicosylethane-1,2-diamine
CID 22930907
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;hexan-1-amine
CID 87602895
N'-[2-(hexatriacontylamino)ethyl]ethane-1,2-diamine
CID 88704371
N-[2-(propylamino)ethyl]-N'-[2-[2-[2-[3-[2-(propylamino)ethylamino]propylamino]ethylamino]ethylamino]ethyl]propane-1,3-diamine
CID 21145819
N',N'-bis(2-aminoethyl)-N-propylpropane-1,3-diamine
CID 20586475
azane;N-propyltetradecan-1-amine
CID 18792183

Frequently Asked Questions

What is the IUPAC name of azane;N'-propylethane-1,2-diamine?
The IUPAC name of azane;N'-propylethane-1,2-diamine (CID 87476258) is azane;N'-propylethane-1,2-diamine.
What is the SMILES notation for azane;N'-propylethane-1,2-diamine?
The canonical SMILES for azane;N'-propylethane-1,2-diamine is CCCNCCN.N.
What is the InChIKey of azane;N'-propylethane-1,2-diamine?
The InChIKey is RYZYAPBCOZVCBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2.H3N/c1-2-4-7-5-3-6;/h7H,2-6H2,1H3;1H3.
What are the key properties of azane;N'-propylethane-1,2-diamine?
azane;N'-propylethane-1,2-diamine has a molecular weight of 119.21 g/mol, XLogP of 0.11, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N'-propylethane-1,2-diamine is sourced from PubChem (CID 87476258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).