2,7-dimethylocta-1,7-dien-3-amine

C10H19N — CID 550746

IUPAC2,7-dimethylocta-1,7-dien-3-amine
SMILESC=C(C)CCCC(N)C(=C)C
InChIInChI=1S/C10H19N/c1-8(2)6-5-7-10(11)9(3)4/h10H,1,3,5-7,11H2,2,4H3
InChIKeyFZOWUSUZHXVSKV-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.64
Rot. Bonds5

About 2,7-dimethylocta-1,7-dien-3-amine

2,7-dimethylocta-1,7-dien-3-amine (PubChem CID 550746) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2,7-dimethylocta-1,7-dien-3-amine.

Molecular Properties

Compound Name2,7-dimethylocta-1,7-dien-3-amine
PubChem CID550746
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2,7-dimethylocta-1,7-dien-3-amine
SMILESC=C(C)CCCC(N)C(=C)C
InChIInChI=1S/C10H19N/c1-8(2)6-5-7-10(11)9(3)4/h10H,1,3,5-7,11H2,2,4H3
InChIKeyFZOWUSUZHXVSKV-UHFFFAOYSA-N
XLogP2.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-Methylhex-5-en-2-amine
CID 12463571
1-(Cyclohex-1-en-1-yl)propan-2-amine
CID 231262
Dodec-1-en-4-amine
CID 14711916
8-Nonen-4-amine
CID 24795685
1-(Cyclohex-1-en-1-yl)ethan-1-amine
CID 45791128
Dodec-11-en-3-amine
CID 53953798
Monoethyl-10-undecenamine
CID 87112392
Oct-1-en-4-amine
CID 10964513
Oct-1-en-3-amine
CID 14102130
(2Z)-2-(fluoromethylidene)octan-1-amine
CID 15595226
(2E)-2-(fluoromethylidene)octan-1-amine
CID 15595227
(2Z)-2-(fluoromethylidene)nonan-1-amine
CID 15595228

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethylocta-1,7-dien-3-amine?
The IUPAC name of 2,7-dimethylocta-1,7-dien-3-amine (CID 550746) is 2,7-dimethylocta-1,7-dien-3-amine.
What is the SMILES notation for 2,7-dimethylocta-1,7-dien-3-amine?
The canonical SMILES for 2,7-dimethylocta-1,7-dien-3-amine is C=C(C)CCCC(N)C(=C)C.
What is the InChIKey of 2,7-dimethylocta-1,7-dien-3-amine?
The InChIKey is FZOWUSUZHXVSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8(2)6-5-7-10(11)9(3)4/h10H,1,3,5-7,11H2,2,4H3.
What are the key properties of 2,7-dimethylocta-1,7-dien-3-amine?
2,7-dimethylocta-1,7-dien-3-amine has a molecular weight of 153.27 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethylocta-1,7-dien-3-amine is sourced from PubChem (CID 550746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).