(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine

C19H33N — CID 170099965

IUPAC(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine
SMILESCCN(C)C/C(C)=C/C=C\C(C)=C\C(=C(C)C)C(C)C
InChIInChI=1S/C19H33N/c1-9-20(8)14-18(7)12-10-11-17(6)13-19(15(2)3)16(4)5/h10-13,15H,9,14H2,1-8H3/b11-10-,17-13+,18-12+
InChIKeyHELFQWDUMJGHJC-UJCYOUSSSA-N
MW275.48 g/mol
LogP5.38
Rot. Bonds7

About (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine

(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine (PubChem CID 170099965) has the molecular formula C19H33N and a molecular weight of 275.48 g/mol. Its IUPAC name is (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine.

Molecular Properties

Compound Name(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine
PubChem CID170099965
Molecular FormulaC19H33N
Molecular Weight275.48 g/mol
Exact Mass275.26
IUPAC Name(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine
SMILESCCN(C)C/C(C)=C/C=C\C(C)=C\C(=C(C)C)C(C)C
InChIInChI=1S/C19H33N/c1-9-20(8)14-18(7)12-10-11-17(6)13-19(15(2)3)16(4)5/h10-13,15H,9,14H2,1-8H3/b11-10-,17-13+,18-12+
InChIKeyHELFQWDUMJGHJC-UJCYOUSSSA-N
XLogP5.38
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.48
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(2Z,4E,6E,8E,10E)-3,7,11-trimethyl-10-propan-2-ylpentadeca-2,4,6,8,10-pentaenoic acid
CID 89261018
(2E,4E,6E,8E,10E,12E,14E)-2,6,11,15,16-pentamethylheptadeca-2,4,6,8,10,12,14-heptaen-1-ol
CID 58633476
(Z)-N-ethyl-N,3,4-trimethyl-2-(2-methylbutan-2-yl)pent-2-en-1-amine
CID 146209928
(E)-N,2,5-trimethyl-4-methylimino-N-propylhex-2-en-1-amine
CID 166464768
ethane;1-[ethyl(methyl)amino]propan-2-one
CID 142250702
(2E,4E)-5-methyl-3-propan-2-ylhepta-2,4-dien-2-ol
CID 143347257
ethyl (2E,4E,6E)-8-acetyloxy-3,7-dimethylocta-2,4,6-trienoate
CID 135037044
4-[(2-amino-2-oxoethyl)-methylamino]-3-methylbut-2-enoic acid
CID 77006189
1-[ethyl(methyl)amino]-3,3-dimethylbutan-2-one
CID 43794888
(3E)-6-methyl-5-propan-2-ylhepta-3,5-dien-2-ol
CID 5363138

Frequently Asked Questions

What is the IUPAC name of (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine?
The IUPAC name of (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine (CID 170099965) is (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine.
What is the SMILES notation for (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine?
The canonical SMILES for (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine is CCN(C)C/C(C)=C/C=C\C(C)=C\C(=C(C)C)C(C)C.
What is the InChIKey of (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine?
The InChIKey is HELFQWDUMJGHJC-UJCYOUSSSA-N. The full InChI is InChI=1S/C19H33N/c1-9-20(8)14-18(7)12-10-11-17(6)13-19(15(2)3)16(4)5/h10-13,15H,9,14H2,1-8H3/b11-10-,17-13+,18-12+.
What are the key properties of (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine?
(2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine has a molecular weight of 275.48 g/mol, XLogP of 5.38, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z,6E)-N-ethyl-N,2,6,9-tetramethyl-8-propan-2-yldeca-2,4,6,8-tetraen-1-amine is sourced from PubChem (CID 170099965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).