2-methoxy-N,2-dimethylnon-8-en-4-amine

C12H25NO — CID 103027271

IUPAC2-methoxy-N,2-dimethylnon-8-en-4-amine
SMILESC=CCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C12H25NO/c1-6-7-8-9-11(13-4)10-12(2,3)14-5/h6,11,13H,1,7-10H2,2-5H3
InChIKeyOMSHDPGFKFDBTI-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.75
Rot. Bonds8

About 2-methoxy-N,2-dimethylnon-8-en-4-amine

2-methoxy-N,2-dimethylnon-8-en-4-amine (PubChem CID 103027271) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-methoxy-N,2-dimethylnon-8-en-4-amine.

Molecular Properties

Compound Name2-methoxy-N,2-dimethylnon-8-en-4-amine
PubChem CID103027271
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-methoxy-N,2-dimethylnon-8-en-4-amine
SMILESC=CCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C12H25NO/c1-6-7-8-9-11(13-4)10-12(2,3)14-5/h6,11,13H,1,7-10H2,2-5H3
InChIKeyOMSHDPGFKFDBTI-UHFFFAOYSA-N
XLogP2.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N,3-dimethylnonadeca-8,11,14-trien-1-amine
CID 90836098
2-(2-but-3-enyloxolan-2-yl)-N-methylethanamine
CID 154668352
1-methoxy-N-methyloct-7-en-3-amine
CID 64297003
N-methyl-1-(oxolan-3-yl)hex-5-en-1-amine
CID 65330081
2-methoxy-2-methyl-N-propyloct-7-en-3-amine
CID 79197465
2-methoxy-N,2-dimethyloct-7-en-3-amine
CID 79197553
2-methoxy-N,2-dimethyl-5-methylideneheptan-3-amine
CID 79197678
N-ethyl-2-methoxy-2-methyloct-7-en-3-amine
CID 79198266
2,2-diethyl-N-pent-4-enyloxan-4-amine
CID 83033007
6-methoxy-N,6-dimethylhept-1-en-4-amine
CID 103024963
N-ethyl-6-methoxy-6-methylhept-1-en-4-amine
CID 103024964
6-methoxy-6-methyl-N-propylhept-1-en-4-amine
CID 103024965

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,2-dimethylnon-8-en-4-amine?
The IUPAC name of 2-methoxy-N,2-dimethylnon-8-en-4-amine (CID 103027271) is 2-methoxy-N,2-dimethylnon-8-en-4-amine.
What is the SMILES notation for 2-methoxy-N,2-dimethylnon-8-en-4-amine?
The canonical SMILES for 2-methoxy-N,2-dimethylnon-8-en-4-amine is C=CCCCC(CC(C)(C)OC)NC.
What is the InChIKey of 2-methoxy-N,2-dimethylnon-8-en-4-amine?
The InChIKey is OMSHDPGFKFDBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-6-7-8-9-11(13-4)10-12(2,3)14-5/h6,11,13H,1,7-10H2,2-5H3.
What are the key properties of 2-methoxy-N,2-dimethylnon-8-en-4-amine?
2-methoxy-N,2-dimethylnon-8-en-4-amine has a molecular weight of 199.34 g/mol, XLogP of 2.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,2-dimethylnon-8-en-4-amine is sourced from PubChem (CID 103027271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).