(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol

C12H23NO — CID 88811405

IUPAC(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol
SMILESC/C(=C\CN)CC/C=C(\C)CCCO
InChIInChI=1S/C12H23NO/c1-11(7-4-10-14)5-3-6-12(2)8-9-13/h5,8,14H,3-4,6-7,9-10,13H2,1-2H3/b11-5+,12-8+
InChIKeyLWRPQTGSSKCUNZ-QAZZFAKDSA-N
MW197.32 g/mol
LogP2.39
Rot. Bonds7

About (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol

(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol (PubChem CID 88811405) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol.

Molecular Properties

Compound Name(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol
PubChem CID88811405
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol
SMILESC/C(=C\CN)CC/C=C(\C)CCCO
InChIInChI=1S/C12H23NO/c1-11(7-4-10-14)5-3-6-12(2)8-9-13/h5,8,14H,3-4,6-7,9-10,13H2,1-2H3/b11-5+,12-8+
InChIKeyLWRPQTGSSKCUNZ-QAZZFAKDSA-N
XLogP2.39
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 142547574
(Z)-10-aminodec-5-en-1-ol
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6-Aminooct-4-en-1-ol
CID 57048558
4-Amino-6,10-dimethylundeca-5,9-dien-1-ol
CID 76468828
3-Amino-7-methyloct-6-en-1-ol
CID 85356853
3-(2-Aminoethylidene)pentane-1,5-diol
CID 87084163
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CID 88648133

Frequently Asked Questions

What is the IUPAC name of (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol?
The IUPAC name of (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol (CID 88811405) is (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol.
What is the SMILES notation for (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol?
The canonical SMILES for (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol is C/C(=C\CN)CC/C=C(\C)CCCO.
What is the InChIKey of (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol?
The InChIKey is LWRPQTGSSKCUNZ-QAZZFAKDSA-N. The full InChI is InChI=1S/C12H23NO/c1-11(7-4-10-14)5-3-6-12(2)8-9-13/h5,8,14H,3-4,6-7,9-10,13H2,1-2H3/b11-5+,12-8+.
What are the key properties of (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol?
(4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,8E)-10-amino-4,8-dimethyldeca-4,8-dien-1-ol is sourced from PubChem (CID 88811405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).