4-methoxy-N-methyldodec-11-en-5-amine

C14H29NO — CID 107009691

IUPAC4-methoxy-N-methyldodec-11-en-5-amine
SMILESC=CCCCCCC(NC)C(CCC)OC
InChIInChI=1S/C14H29NO/c1-5-7-8-9-10-12-13(15-3)14(16-4)11-6-2/h5,13-15H,1,6-12H2,2-4H3
InChIKeyDLTSRBPLGMXHEA-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.53
Rot. Bonds11

About 4-methoxy-N-methyldodec-11-en-5-amine

4-methoxy-N-methyldodec-11-en-5-amine (PubChem CID 107009691) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 4-methoxy-N-methyldodec-11-en-5-amine.

Molecular Properties

Compound Name4-methoxy-N-methyldodec-11-en-5-amine
PubChem CID107009691
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name4-methoxy-N-methyldodec-11-en-5-amine
SMILESC=CCCCCCC(NC)C(CCC)OC
InChIInChI=1S/C14H29NO/c1-5-7-8-9-10-12-13(15-3)14(16-4)11-6-2/h5,13-15H,1,6-12H2,2-4H3
InChIKeyDLTSRBPLGMXHEA-UHFFFAOYSA-N
XLogP3.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.53
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

4-methoxy-N-methyldecan-5-amine
CID 116718740
3-methoxyundec-10-en-4-ylhydrazine
CID 107012653
1,1-dimethoxy-N-methylhept-6-en-2-amine
CID 79492651
4-ethoxy-N-methylpentadecan-5-amine
CID 116717810
N-methylpentadec-1-en-8-amine
CID 107011425
N-ethyl-4-methoxyundecan-5-amine
CID 116719102
N-ethyl-4-methoxydodecan-5-amine
CID 116719103
9-propyldodec-1-ene
CID 174048054
N,4-dipropyldodec-11-en-5-amine
CID 107011617
13-methylhexadec-1-ene
CID 71373615
1,1-dimethoxy-N-propylhept-6-en-2-amine
CID 79493073
2-ethoxy-N-propyldec-9-en-3-amine
CID 107009140

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyldodec-11-en-5-amine?
The IUPAC name of 4-methoxy-N-methyldodec-11-en-5-amine (CID 107009691) is 4-methoxy-N-methyldodec-11-en-5-amine.
What is the SMILES notation for 4-methoxy-N-methyldodec-11-en-5-amine?
The canonical SMILES for 4-methoxy-N-methyldodec-11-en-5-amine is C=CCCCCCC(NC)C(CCC)OC.
What is the InChIKey of 4-methoxy-N-methyldodec-11-en-5-amine?
The InChIKey is DLTSRBPLGMXHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-5-7-8-9-10-12-13(15-3)14(16-4)11-6-2/h5,13-15H,1,6-12H2,2-4H3.
What are the key properties of 4-methoxy-N-methyldodec-11-en-5-amine?
4-methoxy-N-methyldodec-11-en-5-amine has a molecular weight of 227.39 g/mol, XLogP of 3.53, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyldodec-11-en-5-amine is sourced from PubChem (CID 107009691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).