(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol

C14H27NO — CID 16729182

IUPAC(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol
SMILESCC(=CCC/C(C)=C/CO)CCCN(C)C
InChIInChI=1S/C14H27NO/c1-13(9-6-11-15(3)4)7-5-8-14(2)10-12-16/h7,10,16H,5-6,8-9,11-12H2,1-4H3/b13-7?,14-10+
InChIKeyDHLUBBQTPDVPMM-LDACQEBESA-N
MW225.38 g/mol
LogP2.99
Rot. Bonds8

About (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol

(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol (PubChem CID 16729182) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol.

Molecular Properties

Compound Name(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol
PubChem CID16729182
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol
SMILESCC(=CCC/C(C)=C/CO)CCCN(C)C
InChIInChI=1S/C14H27NO/c1-13(9-6-11-15(3)4)7-5-8-14(2)10-12-16/h7,10,16H,5-6,8-9,11-12H2,1-4H3/b13-7?,14-10+
InChIKeyDHLUBBQTPDVPMM-LDACQEBESA-N
XLogP2.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
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 (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol?
The IUPAC name of (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol (CID 16729182) is (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol.
What is the SMILES notation for (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol?
The canonical SMILES for (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol is CC(=CCC/C(C)=C/CO)CCCN(C)C.
What is the InChIKey of (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol?
The InChIKey is DHLUBBQTPDVPMM-LDACQEBESA-N. The full InChI is InChI=1S/C14H27NO/c1-13(9-6-11-15(3)4)7-5-8-14(2)10-12-16/h7,10,16H,5-6,8-9,11-12H2,1-4H3/b13-7?,14-10+.
What are the key properties of (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol?
(2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.99, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-10-(dimethylamino)-3,7-dimethyldeca-2,6-dien-1-ol is sourced from PubChem (CID 16729182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).