tridecane-1,4,7,10,13-pentamine

C13H33N5 — CID 86224803

IUPACtridecane-1,4,7,10,13-pentamine
SMILESNCCCC(N)CCC(N)CCC(N)CCCN
InChIInChI=1S/C13H33N5/c14-9-1-3-11(16)5-7-13(18)8-6-12(17)4-2-10-15/h11-13H,1-10,14-18H2
InChIKeyOMQVUZKQULXYMF-UHFFFAOYSA-N
MW259.44 g/mol
LogP0.01
Rot. Bonds12

About tridecane-1,4,7,10,13-pentamine

tridecane-1,4,7,10,13-pentamine (PubChem CID 86224803) has the molecular formula C13H33N5 and a molecular weight of 259.44 g/mol. Its IUPAC name is tridecane-1,4,7,10,13-pentamine.

Molecular Properties

Compound Nametridecane-1,4,7,10,13-pentamine
PubChem CID86224803
Molecular FormulaC13H33N5
Molecular Weight259.44 g/mol
Exact Mass259.27
IUPAC Nametridecane-1,4,7,10,13-pentamine
SMILESNCCCC(N)CCC(N)CCC(N)CCCN
InChIInChI=1S/C13H33N5/c14-9-1-3-11(16)5-7-13(18)8-6-12(17)4-2-10-15/h11-13H,1-10,14-18H2
InChIKeyOMQVUZKQULXYMF-UHFFFAOYSA-N
XLogP0.01
TPSA130.10 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 50.01
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Analyze tridecane-1,4,7,10,13-pentamine 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

heptane-1,4,7-triamine;tetrahydrochloride
CID 172714614
octane-1,4,8-triamine
CID 18544198
tridecane-1,4,7,10-tetramine
CID 175128174
pentacosane-1,13,25-triamine
CID 174653759
octane-1,1,4,8-tetramine
CID 139682493
heptane-1,4-diamine
CID 18547393
(2S)-2,5-diaminopentane-1-thiol
CID 175679057
octane-1,3,6,8-tetramine
CID 18680656
7-N-[3-(3-aminopropylamino)propyl]heptane-1,4,7-triamine
CID 172704929
hexane-1,4-diamine;hydrochloride
CID 118144198
hexane-1,4-diamine;trihydrate
CID 173409010
nonadecane-1,13-diamine
CID 102135569

Frequently Asked Questions

What is the IUPAC name of tridecane-1,4,7,10,13-pentamine?
The IUPAC name of tridecane-1,4,7,10,13-pentamine (CID 86224803) is tridecane-1,4,7,10,13-pentamine.
What is the SMILES notation for tridecane-1,4,7,10,13-pentamine?
The canonical SMILES for tridecane-1,4,7,10,13-pentamine is NCCCC(N)CCC(N)CCC(N)CCCN.
What is the InChIKey of tridecane-1,4,7,10,13-pentamine?
The InChIKey is OMQVUZKQULXYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H33N5/c14-9-1-3-11(16)5-7-13(18)8-6-12(17)4-2-10-15/h11-13H,1-10,14-18H2.
What are the key properties of tridecane-1,4,7,10,13-pentamine?
tridecane-1,4,7,10,13-pentamine has a molecular weight of 259.44 g/mol, XLogP of 0.01, 12 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tridecane-1,4,7,10,13-pentamine is sourced from PubChem (CID 86224803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).