N,N'-dipyridin-4-yldecane-1,10-diamine

C20H30N4 — CID 12069891

IUPACN,N'-dipyridin-4-yldecane-1,10-diamine
SMILESc1cc(NCCCCCCCCCCNc2ccncc2)ccn1
InChIInChI=1S/C20H30N4/c1(3-5-7-13-23-19-9-15-21-16-10-19)2-4-6-8-14-24-20-11-17-22-18-12-20/h9-12,15-18H,1-8,13-14H2,(H,21,23)(H,22,24)
InChIKeyNPFMKSWHBJHKPB-UHFFFAOYSA-N
MW326.49 g/mol
LogP5.12
Rot. Bonds13

About N,N'-dipyridin-4-yldecane-1,10-diamine

N,N'-dipyridin-4-yldecane-1,10-diamine (PubChem CID 12069891) has the molecular formula C20H30N4 and a molecular weight of 326.49 g/mol. Its IUPAC name is N,N'-dipyridin-4-yldecane-1,10-diamine.

Molecular Properties

Compound NameN,N'-dipyridin-4-yldecane-1,10-diamine
PubChem CID12069891
Molecular FormulaC20H30N4
Molecular Weight326.49 g/mol
Exact Mass326.25
IUPAC NameN,N'-dipyridin-4-yldecane-1,10-diamine
SMILESc1cc(NCCCCCCCCCCNc2ccncc2)ccn1
InChIInChI=1S/C20H30N4/c1(3-5-7-13-23-19-9-15-21-16-10-19)2-4-6-8-14-24-20-11-17-22-18-12-20/h9-12,15-18H,1-8,13-14H2,(H,21,23)(H,22,24)
InChIKeyNPFMKSWHBJHKPB-UHFFFAOYSA-N
XLogP5.12
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.49
LogP ≤ 55.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-dipyridin-4-yldecane-1,10-diamine?
The IUPAC name of N,N'-dipyridin-4-yldecane-1,10-diamine (CID 12069891) is N,N'-dipyridin-4-yldecane-1,10-diamine.
What is the SMILES notation for N,N'-dipyridin-4-yldecane-1,10-diamine?
The canonical SMILES for N,N'-dipyridin-4-yldecane-1,10-diamine is c1cc(NCCCCCCCCCCNc2ccncc2)ccn1.
What is the InChIKey of N,N'-dipyridin-4-yldecane-1,10-diamine?
The InChIKey is NPFMKSWHBJHKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4/c1(3-5-7-13-23-19-9-15-21-16-10-19)2-4-6-8-14-24-20-11-17-22-18-12-20/h9-12,15-18H,1-8,13-14H2,(H,21,23)(H,22,24).
What are the key properties of N,N'-dipyridin-4-yldecane-1,10-diamine?
N,N'-dipyridin-4-yldecane-1,10-diamine has a molecular weight of 326.49 g/mol, XLogP of 5.12, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipyridin-4-yldecane-1,10-diamine is sourced from PubChem (CID 12069891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).