(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine

C17H35NO — CID 167309488

IUPAC(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine
SMILESCCCC(CC/C=C\C(C)OC)C(C)CCN(C)C
InChIInChI=1S/C17H35NO/c1-7-10-17(15(2)13-14-18(4)5)12-9-8-11-16(3)19-6/h8,11,15-17H,7,9-10,12-14H2,1-6H3/b11-8-
InChIKeyDPBUEUDNECIKMS-FLIBITNWSA-N
MW269.47 g/mol
LogP4.36
Rot. Bonds11

About (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine

(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine (PubChem CID 167309488) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine.

Molecular Properties

Compound Name(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine
PubChem CID167309488
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC Name(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine
SMILESCCCC(CC/C=C\C(C)OC)C(C)CCN(C)C
InChIInChI=1S/C17H35NO/c1-7-10-17(15(2)13-14-18(4)5)12-9-8-11-16(3)19-6/h8,11,15-17H,7,9-10,12-14H2,1-6H3/b11-8-
InChIKeyDPBUEUDNECIKMS-FLIBITNWSA-N
XLogP4.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.47
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine?
The IUPAC name of (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine (CID 167309488) is (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine.
What is the SMILES notation for (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine?
The canonical SMILES for (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine is CCCC(CC/C=C\C(C)OC)C(C)CCN(C)C.
What is the InChIKey of (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine?
The InChIKey is DPBUEUDNECIKMS-FLIBITNWSA-N. The full InChI is InChI=1S/C17H35NO/c1-7-10-17(15(2)13-14-18(4)5)12-9-8-11-16(3)19-6/h8,11,15-17H,7,9-10,12-14H2,1-6H3/b11-8-.
What are the key properties of (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine?
(Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine has a molecular weight of 269.47 g/mol, XLogP of 4.36, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-9-methoxy-N,N,3-trimethyl-4-propyldec-7-en-1-amine is sourced from PubChem (CID 167309488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).