(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine

C10H19NO — CID 144515472

IUPAC(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine
SMILESC=CC(CC/C=C(/C)CN)OC
InChIInChI=1S/C10H19NO/c1-4-10(12-3)7-5-6-9(2)8-11/h4,6,10H,1,5,7-8,11H2,2-3H3/b9-6-
InChIKeyADTNIDUCLXXYRV-TWGQIWQCSA-N
MW169.27 g/mol
LogP1.87
Rot. Bonds6

About (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine

(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine (PubChem CID 144515472) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine.

Molecular Properties

Compound Name(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine
PubChem CID144515472
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine
SMILESC=CC(CC/C=C(/C)CN)OC
InChIInChI=1S/C10H19NO/c1-4-10(12-3)7-5-6-9(2)8-11/h4,6,10H,1,5,7-8,11H2,2-3H3/b9-6-
InChIKeyADTNIDUCLXXYRV-TWGQIWQCSA-N
XLogP1.87
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-methoxyoct-7-en-2-ol
CID 11550053
methyl 10-amino-5,9-dimethyldeca-2,8-dienoate
CID 54405734
2,7-dimethylocta-2,7-dien-1-amine
CID 550648
3-methoxynon-1-ene
CID 12563924
ethane-1,2-diol;3-methoxypent-1-ene
CID 90081952
2-methyl-5-methylsulfonylpent-2-en-1-amine
CID 103392241
3-[(2E)-2,6-dimethylocta-2,7-dienoxy]propane-1,2-diol
CID 102282318
(Z)-3-methoxy-2-methylprop-2-en-1-amine
CID 171800320
12,12-dimethoxy-5,9-dimethyldodec-8-en-2-ol
CID 156747026
ethane;1-[5-methoxyhept-6-enyl(propyl)amino]propan-2-ol
CID 144970530
4-methoxy-N-methylhexa-1,5-dien-2-amine
CID 88966208
3-(3-methylbut-2-enoxy)pent-1-ene
CID 175435022

Frequently Asked Questions

What is the IUPAC name of (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine?
The IUPAC name of (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine (CID 144515472) is (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine.
What is the SMILES notation for (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine?
The canonical SMILES for (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine is C=CC(CC/C=C(/C)CN)OC.
What is the InChIKey of (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine?
The InChIKey is ADTNIDUCLXXYRV-TWGQIWQCSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-10(12-3)7-5-6-9(2)8-11/h4,6,10H,1,5,7-8,11H2,2-3H3/b9-6-.
What are the key properties of (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine?
(2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-6-methoxy-2-methylocta-2,7-dien-1-amine is sourced from PubChem (CID 144515472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).