N,N'-diheptyldecane-1,10-diamine

C24H52N2 — CID 3028161

IUPACN,N'-diheptyldecane-1,10-diamine
SMILESCCCCCCCNCCCCCCCCCCNCCCCCCC
InChIInChI=1S/C24H52N2/c1-3-5-7-13-17-21-25-23-19-15-11-9-10-12-16-20-24-26-22-18-14-8-6-4-2/h25-26H,3-24H2,1-2H3
InChIKeySIDUDQQUGWUVIX-UHFFFAOYSA-N
MW368.69 g/mol
LogP7.23
Rot. Bonds23

About N,N'-diheptyldecane-1,10-diamine

N,N'-diheptyldecane-1,10-diamine (PubChem CID 3028161) has the molecular formula C24H52N2 and a molecular weight of 368.69 g/mol. Its IUPAC name is N,N'-diheptyldecane-1,10-diamine.

Molecular Properties

Compound NameN,N'-diheptyldecane-1,10-diamine
PubChem CID3028161
Molecular FormulaC24H52N2
Molecular Weight368.69 g/mol
Exact Mass368.41
IUPAC NameN,N'-diheptyldecane-1,10-diamine
SMILESCCCCCCCNCCCCCCCCCCNCCCCCCC
InChIInChI=1S/C24H52N2/c1-3-5-7-13-17-21-25-23-19-15-11-9-10-12-16-20-24-26-22-18-14-8-6-4-2/h25-26H,3-24H2,1-2H3
InChIKeySIDUDQQUGWUVIX-UHFFFAOYSA-N
XLogP7.23
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds23
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.69
LogP ≤ 57.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hexyltridecan-1-amine
CID 87659278
octane;N-octylnonan-1-amine
CID 145152206
N-undecyltetradecan-1-amine
CID 166059375
N,N'-diheptylhexane-1,6-diamine
CID 3028571
N-docosyldocosan-1-amine;hydrochloride
CID 173181498
N,N'-di(nonyl)ethane-1,2-diamine
CID 151189669
methane;N-octyloctan-1-amine
CID 87294693
N-butyltetradecan-1-amine
CID 3548872
N-hexylhexan-1-amine;hydrochloride
CID 519999
N-octylnonan-1-amine;hydrochloride
CID 90480847
sulfanium;N-decyldecan-1-amine;chloride
CID 158756952
azane;N-hexyldecan-1-amine;dihydroiodide
CID 173206397

Frequently Asked Questions

What is the IUPAC name of N,N'-diheptyldecane-1,10-diamine?
The IUPAC name of N,N'-diheptyldecane-1,10-diamine (CID 3028161) is N,N'-diheptyldecane-1,10-diamine.
What is the SMILES notation for N,N'-diheptyldecane-1,10-diamine?
The canonical SMILES for N,N'-diheptyldecane-1,10-diamine is CCCCCCCNCCCCCCCCCCNCCCCCCC.
What is the InChIKey of N,N'-diheptyldecane-1,10-diamine?
The InChIKey is SIDUDQQUGWUVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52N2/c1-3-5-7-13-17-21-25-23-19-15-11-9-10-12-16-20-24-26-22-18-14-8-6-4-2/h25-26H,3-24H2,1-2H3.
What are the key properties of N,N'-diheptyldecane-1,10-diamine?
N,N'-diheptyldecane-1,10-diamine has a molecular weight of 368.69 g/mol, XLogP of 7.23, 23 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-diheptyldecane-1,10-diamine is sourced from PubChem (CID 3028161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).