(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine

C17H24N2 — CID 129090482

IUPAC(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine
SMILESC=C(/C=C(C)\C(C)=C/NC)c1c(C)cc(C)nc1C
InChIInChI=1S/C17H24N2/c1-11(14(4)10-18-7)8-12(2)17-13(3)9-15(5)19-16(17)6/h8-10,18H,2H2,1,3-7H3/b11-8-,14-10-
InChIKeyOHLASUDZSNYLEI-JLKXBCQYSA-N
MW256.39 g/mol
LogP4.09
Rot. Bonds4

About (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine

(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine (PubChem CID 129090482) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine.

Molecular Properties

Compound Name(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine
PubChem CID129090482
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine
SMILESC=C(/C=C(C)\C(C)=C/NC)c1c(C)cc(C)nc1C
InChIInChI=1S/C17H24N2/c1-11(14(4)10-18-7)8-12(2)17-13(3)9-15(5)19-16(17)6/h8-10,18H,2H2,1,3-7H3/b11-8-,14-10-
InChIKeyOHLASUDZSNYLEI-JLKXBCQYSA-N
XLogP4.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine?
The IUPAC name of (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine (CID 129090482) is (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine.
What is the SMILES notation for (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine?
The canonical SMILES for (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine is C=C(/C=C(C)\C(C)=C/NC)c1c(C)cc(C)nc1C.
What is the InChIKey of (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine?
The InChIKey is OHLASUDZSNYLEI-JLKXBCQYSA-N. The full InChI is InChI=1S/C17H24N2/c1-11(14(4)10-18-7)8-12(2)17-13(3)9-15(5)19-16(17)6/h8-10,18H,2H2,1,3-7H3/b11-8-,14-10-.
What are the key properties of (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine?
(1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine has a molecular weight of 256.39 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-N,2,3-trimethyl-5-(2,4,6-trimethyl-3-pyridinyl)hexa-1,3,5-trien-1-amine is sourced from PubChem (CID 129090482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).