(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine

C12H26N2 — CID 134526562

IUPAC(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine
SMILESCCC/C=C\CCC(C)(N)CCNC
InChIInChI=1S/C12H26N2/c1-4-5-6-7-8-9-12(2,13)10-11-14-3/h6-7,14H,4-5,8-11,13H2,1-3H3/b7-6-
InChIKeyYCWOKQGVPSSFFM-SREVYHEPSA-N
MW198.35 g/mol
LogP2.45
Rot. Bonds8

About (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine

(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine (PubChem CID 134526562) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine
PubChem CID134526562
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine
SMILESCCC/C=C\CCC(C)(N)CCNC
InChIInChI=1S/C12H26N2/c1-4-5-6-7-8-9-12(2,13)10-11-14-3/h6-7,14H,4-5,8-11,13H2,1-3H3/b7-6-
InChIKeyYCWOKQGVPSSFFM-SREVYHEPSA-N
XLogP2.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine?
The IUPAC name of (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine (CID 134526562) is (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine.
What is the SMILES notation for (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine?
The canonical SMILES for (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine is CCC/C=C\CCC(C)(N)CCNC.
What is the InChIKey of (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine?
The InChIKey is YCWOKQGVPSSFFM-SREVYHEPSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-5-6-7-8-9-12(2,13)10-11-14-3/h6-7,14H,4-5,8-11,13H2,1-3H3/b7-6-.
What are the key properties of (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine?
(Z)-1-N,3-dimethyldec-6-ene-1,3-diamine has a molecular weight of 198.35 g/mol, XLogP of 2.45, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N,3-dimethyldec-6-ene-1,3-diamine is sourced from PubChem (CID 134526562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).