1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine

C14H10N2 — CID 20721702

IUPAC1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine
SMILESC=C=C=C=C=C=C=C=C=C=C=C(NC)NC
InChIInChI=1S/C14H10N2/c1-4-5-6-7-8-9-10-11-12-13-14(15-2)16-3/h15-16H,1H2,2-3H3
InChIKeySNOMKGCDALZNNH-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.45
Rot. Bonds2

About 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine

1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine (PubChem CID 20721702) has the molecular formula C14H10N2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine
PubChem CID20721702
Molecular FormulaC14H10N2
Molecular Weight206.25 g/mol
Exact Mass206.08
IUPAC Name1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine
SMILESC=C=C=C=C=C=C=C=C=C=C=C(NC)NC
InChIInChI=1S/C14H10N2/c1-4-5-6-7-8-9-10-11-12-13-14(15-2)16-3/h15-16H,1H2,2-3H3
InChIKeySNOMKGCDALZNNH-UHFFFAOYSA-N
XLogP1.45
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine?
The IUPAC name of 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine (CID 20721702) is 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine.
What is the SMILES notation for 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine?
The canonical SMILES for 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine is C=C=C=C=C=C=C=C=C=C=C=C(NC)NC.
What is the InChIKey of 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine?
The InChIKey is SNOMKGCDALZNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2/c1-4-5-6-7-8-9-10-11-12-13-14(15-2)16-3/h15-16H,1H2,2-3H3.
What are the key properties of 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine?
1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine has a molecular weight of 206.25 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N'-dimethyldodeca-1,2,3,4,5,6,7,8,9,10,11-undecaene-1,1-diamine is sourced from PubChem (CID 20721702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).