1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene

C16H24 — CID 142305251

IUPAC1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene
SMILESC/C=C(\c1ccccc1C)C(CC)C(C)C
InChIInChI=1S/C16H24/c1-6-14(12(3)4)15(7-2)16-11-9-8-10-13(16)5/h7-12,14H,6H2,1-5H3/b15-7-
InChIKeyNQERIWKKANVWOW-CHHVJCJISA-N
MW216.37 g/mol
LogP5.08
Rot. Bonds4

About 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene

1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene (PubChem CID 142305251) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene.

Molecular Properties

Compound Name1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene
PubChem CID142305251
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene
SMILESC/C=C(\c1ccccc1C)C(CC)C(C)C
InChIInChI=1S/C16H24/c1-6-14(12(3)4)15(7-2)16-11-9-8-10-13(16)5/h7-12,14H,6H2,1-5H3/b15-7-
InChIKeyNQERIWKKANVWOW-CHHVJCJISA-N
XLogP5.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500216.37
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(Z)-N,N,2-trimethyl-3-(2-methylphenyl)pent-3-en-1-amine;hydrochloride
CID 140979903
ethane;ethanethial;1-[(2Z,5E,7Z)-4-ethyl-5-methylnona-2,5,7-trien-3-yl]-2-methylbenzene;methanamine
CID 142305255
3-methyl-1-(2-methylphenyl)pentan-1-one
CID 62620781
1-[(E)-but-2-en-2-yl]-2-methylbenzene
CID 12835573
(E)-1-(2-methylphenyl)prop-1-ene-1-thiol
CID 142259115
(Z)-1-(2-methylphenyl)prop-1-en-1-amine
CID 126678655
1-[(2E,4Z)-hepta-2,4-dien-3-yl]-2-methylbenzene
CID 143750255
2-[ethyl(propan-2-yl)amino]-1-(2-methylphenyl)ethanone
CID 43795126
N-[(2S)-1-[[(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
CID 99845714
N-(1-chlorobutan-2-yl)-2-methylbenzamide
CID 114294187
(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide
CID 142370556
(5Z)-N-ethyl-3-methyl-5-(2-methylphenyl)hepta-1,5-dien-2-amine
CID 171560882

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene?
The IUPAC name of 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene (CID 142305251) is 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene.
What is the SMILES notation for 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene?
The canonical SMILES for 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene is C/C=C(\c1ccccc1C)C(CC)C(C)C.
What is the InChIKey of 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene?
The InChIKey is NQERIWKKANVWOW-CHHVJCJISA-N. The full InChI is InChI=1S/C16H24/c1-6-14(12(3)4)15(7-2)16-11-9-8-10-13(16)5/h7-12,14H,6H2,1-5H3/b15-7-.
What are the key properties of 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene?
1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene has a molecular weight of 216.37 g/mol, XLogP of 5.08, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-4-ethyl-5-methylhex-2-en-3-yl]-2-methylbenzene is sourced from PubChem (CID 142305251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).