(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine

C13H25N — CID 11954735

IUPAC(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine
SMILESC=CC[C@H](N)C[C@@H](C)CCC=C(C)C
InChIInChI=1S/C13H25N/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-13H,1,6-7,9-10,14H2,2-4H3/t12-,13-/m0/s1
InChIKeyUYLCSDGYBSTPDM-STQMWFEESA-N
MW195.35 g/mol
LogP3.66
Rot. Bonds7

About (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine

(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine (PubChem CID 11954735) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine.

Molecular Properties

Compound Name(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine
PubChem CID11954735
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine
SMILESC=CC[C@H](N)C[C@@H](C)CCC=C(C)C
InChIInChI=1S/C13H25N/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-13H,1,6-7,9-10,14H2,2-4H3/t12-,13-/m0/s1
InChIKeyUYLCSDGYBSTPDM-STQMWFEESA-N
XLogP3.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(6S)-6,10-dimethylundeca-1,9-dien-4-ol
CID 11030747
6,10-dimethylundeca-1,9-dien-4-ol
CID 11019804
5,9-dimethyldeca-1,8-diene
CID 12578605
(5R)-5,9-dimethyldeca-1,8-dien-3-ol
CID 10986927
(4S)-6-methylhept-1-en-4-amine
CID 55284878
3,7-dimethyl-N-prop-2-enyloct-6-en-1-imine
CID 138519610
(2R)-2,6-dimethylhept-5-en-1-amine
CID 163211564
6,8,8-trimethylnon-1-en-4-amine
CID 115813808
2-hydroxy-4,8-dimethylnon-7-enenitrile
CID 59050259
5,9-dimethyldeca-1,8-dien-3-one
CID 85299318
(2Z,4S,6R)-6,10-dimethylundeca-2,9-dien-4-ol
CID 139824549
magnesium;(6S)-2,6-dimethyloct-2-ene;chloride
CID 164665719

Frequently Asked Questions

What is the IUPAC name of (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine?
The IUPAC name of (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine (CID 11954735) is (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine.
What is the SMILES notation for (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine?
The canonical SMILES for (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine is C=CC[C@H](N)C[C@@H](C)CCC=C(C)C.
What is the InChIKey of (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine?
The InChIKey is UYLCSDGYBSTPDM-STQMWFEESA-N. The full InChI is InChI=1S/C13H25N/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-13H,1,6-7,9-10,14H2,2-4H3/t12-,13-/m0/s1.
What are the key properties of (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine?
(4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine has a molecular weight of 195.35 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,6S)-6,10-dimethylundeca-1,9-dien-4-amine is sourced from PubChem (CID 11954735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).