6-methoxynona-4,6-dien-2-amine

C10H19NO — CID 90755052

IUPAC6-methoxynona-4,6-dien-2-amine
SMILESCCC=C(C=CCC(C)N)OC
InChIInChI=1S/C10H19NO/c1-4-6-10(12-3)8-5-7-9(2)11/h5-6,8-9H,4,7,11H2,1-3H3
InChIKeyXGKFPXLSDALITH-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.22
Rot. Bonds5

About 6-methoxynona-4,6-dien-2-amine

6-methoxynona-4,6-dien-2-amine (PubChem CID 90755052) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 6-methoxynona-4,6-dien-2-amine.

Molecular Properties

Compound Name6-methoxynona-4,6-dien-2-amine
PubChem CID90755052
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name6-methoxynona-4,6-dien-2-amine
SMILESCCC=C(C=CCC(C)N)OC
InChIInChI=1S/C10H19NO/c1-4-6-10(12-3)8-5-7-9(2)11/h5-6,8-9H,4,7,11H2,1-3H3
InChIKeyXGKFPXLSDALITH-UHFFFAOYSA-N
XLogP2.22
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

6-Fluoro-4-methoxy-6-methylcyclohexa-2,4-dien-1-amine
CID 68421839
(3Z,5Z)-5-(3,3,3-trifluoropropoxy)octa-3,5-dien-2-amine
CID 163869876
5-Amino-3-ethoxycyclopentadiene
CID 129735658
4-Methoxycyclohexa-2,4-dien-1-amine
CID 15267074
1-(3,4-dihydro-2H-oxepin-7-ylidene)butan-2-amine
CID 57009658
4-Ethoxycyclohexa-2,4-dien-1-amine
CID 67819232
4-(5-Methylcyclohexa-1,5-dien-1-yl)oxycyclohexa-2,4-dien-1-amine
CID 68200193
4-Methoxy-2-methylcyclohexa-2,4-dien-1-amine
CID 70224953
(4Z,5Z)-4-ethylidene-7-methoxyocta-5,7-dien-2-amine
CID 88585562
4-Butoxycyclohexa-2,4-dien-1-amine
CID 89073852
(3Z)-5-methoxy-3-methylhexa-3,5-dien-2-amine
CID 89139574
(3Z)-5-[(2-methylpropan-2-yl)oxy]hexa-3,5-dien-2-amine
CID 89153797

Frequently Asked Questions

What is the IUPAC name of 6-methoxynona-4,6-dien-2-amine?
The IUPAC name of 6-methoxynona-4,6-dien-2-amine (CID 90755052) is 6-methoxynona-4,6-dien-2-amine.
What is the SMILES notation for 6-methoxynona-4,6-dien-2-amine?
The canonical SMILES for 6-methoxynona-4,6-dien-2-amine is CCC=C(C=CCC(C)N)OC.
What is the InChIKey of 6-methoxynona-4,6-dien-2-amine?
The InChIKey is XGKFPXLSDALITH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-6-10(12-3)8-5-7-9(2)11/h5-6,8-9H,4,7,11H2,1-3H3.
What are the key properties of 6-methoxynona-4,6-dien-2-amine?
6-methoxynona-4,6-dien-2-amine has a molecular weight of 169.27 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxynona-4,6-dien-2-amine is sourced from PubChem (CID 90755052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).