cyclodecane-1,6-diamine

C10H22N2 — CID 2752666

IUPACcyclodecane-1,6-diamine
SMILESNC1CCCCC(N)CCCC1
InChIInChI=1S/C10H22N2/c11-9-5-1-2-6-10(12)8-4-3-7-9/h9-10H,1-8,11-12H2
InChIKeyJEJBVIWULJYFTM-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.78
Rot. Bonds

About cyclodecane-1,6-diamine

cyclodecane-1,6-diamine (PubChem CID 2752666) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is cyclodecane-1,6-diamine.

Molecular Properties

Compound Namecyclodecane-1,6-diamine
PubChem CID2752666
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Namecyclodecane-1,6-diamine
SMILESNC1CCCCC(N)CCCC1
InChIInChI=1S/C10H22N2/c11-9-5-1-2-6-10(12)8-4-3-7-9/h9-10H,1-8,11-12H2
InChIKeyJEJBVIWULJYFTM-UHFFFAOYSA-N
XLogP1.78
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,8-Octanediamine
CID 24250
1,10-Decanediamine
CID 1317
1,12-Dodecanediamine
CID 17727
2-Octylamine
CID 12735
Nonamethylenediamine
CID 69534
Cyclododecanamine
CID 2897
1,11-Undecanediamine
CID 69966
2-Undecanamine
CID 114476
2-Aminotridecane
CID 123297
2-Octylamine, (2R)-
CID 2734519
2-Octylamine, (2S)-
CID 6999019
6-Aminoundecane
CID 141845

Frequently Asked Questions

What is the IUPAC name of cyclodecane-1,6-diamine?
The IUPAC name of cyclodecane-1,6-diamine (CID 2752666) is cyclodecane-1,6-diamine.
What is the SMILES notation for cyclodecane-1,6-diamine?
The canonical SMILES for cyclodecane-1,6-diamine is NC1CCCCC(N)CCCC1.
What is the InChIKey of cyclodecane-1,6-diamine?
The InChIKey is JEJBVIWULJYFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c11-9-5-1-2-6-10(12)8-4-3-7-9/h9-10H,1-8,11-12H2.
What are the key properties of cyclodecane-1,6-diamine?
cyclodecane-1,6-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.78, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclodecane-1,6-diamine is sourced from PubChem (CID 2752666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).