(E)-dodec-1-en-1-amine

C12H25N — CID 14324878

IUPAC(E)-dodec-1-en-1-amine
SMILESCCCCCCCCCC/C=C/N
InChIInChI=1S/C12H25N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h11-12H,2-10,13H2,1H3/b12-11+
InChIKeyOGNIRUSROLJRSJ-VAWYXSNFSA-N
MW183.34 g/mol
LogP3.99
Rot. Bonds9

About (E)-dodec-1-en-1-amine

(E)-dodec-1-en-1-amine (PubChem CID 14324878) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is (E)-dodec-1-en-1-amine.

Molecular Properties

Compound Name(E)-dodec-1-en-1-amine
PubChem CID14324878
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name(E)-dodec-1-en-1-amine
SMILESCCCCCCCCCC/C=C/N
InChIInChI=1S/C12H25N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h11-12H,2-10,13H2,1H3/b12-11+
InChIKeyOGNIRUSROLJRSJ-VAWYXSNFSA-N
XLogP3.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 (E)-dodec-1-en-1-amine?
The IUPAC name of (E)-dodec-1-en-1-amine (CID 14324878) is (E)-dodec-1-en-1-amine.
What is the SMILES notation for (E)-dodec-1-en-1-amine?
The canonical SMILES for (E)-dodec-1-en-1-amine is CCCCCCCCCC/C=C/N.
What is the InChIKey of (E)-dodec-1-en-1-amine?
The InChIKey is OGNIRUSROLJRSJ-VAWYXSNFSA-N. The full InChI is InChI=1S/C12H25N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h11-12H,2-10,13H2,1H3/b12-11+.
What are the key properties of (E)-dodec-1-en-1-amine?
(E)-dodec-1-en-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.99, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dodec-1-en-1-amine is sourced from PubChem (CID 14324878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).