(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine

C13H21N — CID 155374096

IUPAC(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine
SMILESC=C(/C=C\C)/C=C\C=C/CCN(C)C
InChIInChI=1S/C13H21N/c1-5-10-13(2)11-8-6-7-9-12-14(3)4/h5-8,10-11H,2,9,12H2,1,3-4H3/b7-6-,10-5-,11-8-
InChIKeyALLCUOVBQRZLRY-WWAJRPLYSA-N
MW191.32 g/mol
LogP3.18
Rot. Bonds6

About (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine

(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine (PubChem CID 155374096) has the molecular formula C13H21N and a molecular weight of 191.32 g/mol. Its IUPAC name is (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine.

Molecular Properties

Compound Name(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine
PubChem CID155374096
Molecular FormulaC13H21N
Molecular Weight191.32 g/mol
Exact Mass191.17
IUPAC Name(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine
SMILESC=C(/C=C\C)/C=C\C=C/CCN(C)C
InChIInChI=1S/C13H21N/c1-5-10-13(2)11-8-6-7-9-12-14(3)4/h5-8,10-11H,2,9,12H2,1,3-4H3/b7-6-,10-5-,11-8-
InChIKeyALLCUOVBQRZLRY-WWAJRPLYSA-N
XLogP3.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.32
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine?
The IUPAC name of (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine (CID 155374096) is (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine.
What is the SMILES notation for (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine?
The canonical SMILES for (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine is C=C(/C=C\C)/C=C\C=C/CCN(C)C.
What is the InChIKey of (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine?
The InChIKey is ALLCUOVBQRZLRY-WWAJRPLYSA-N. The full InChI is InChI=1S/C13H21N/c1-5-10-13(2)11-8-6-7-9-12-14(3)4/h5-8,10-11H,2,9,12H2,1,3-4H3/b7-6-,10-5-,11-8-.
What are the key properties of (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine?
(3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine has a molecular weight of 191.32 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z,8Z)-N,N-dimethyl-7-methylidenedeca-3,5,8-trien-1-amine is sourced from PubChem (CID 155374096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).