1-cyclohexa-2,4-dien-1-yl-2-propylbenzene

C15H18 — CID 156826957

IUPAC1-cyclohexa-2,4-dien-1-yl-2-propylbenzene
SMILESCCCc1ccccc1C1C=CC=CC1
InChIInChI=1S/C15H18/c1-2-8-13-11-6-7-12-15(13)14-9-4-3-5-10-14/h3-7,9,11-12,14H,2,8,10H2,1H3
InChIKeyDYQXMKPXVVKYQE-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.24
Rot. Bonds3

About 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene

1-cyclohexa-2,4-dien-1-yl-2-propylbenzene (PubChem CID 156826957) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene.

Molecular Properties

Compound Name1-cyclohexa-2,4-dien-1-yl-2-propylbenzene
PubChem CID156826957
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1-cyclohexa-2,4-dien-1-yl-2-propylbenzene
SMILESCCCc1ccccc1C1C=CC=CC1
InChIInChI=1S/C15H18/c1-2-8-13-11-6-7-12-15(13)14-9-4-3-5-10-14/h3-7,9,11-12,14H,2,8,10H2,1H3
InChIKeyDYQXMKPXVVKYQE-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-cyclohexa-2,4-dien-1-ylbenzenesulfonamide
CID 67426658
2-(cyclohexa-2,4-dien-1-ylmethyl)-N,N-dimethylaniline
CID 163487751
2-(2-cyclohexa-2,4-dien-1-ylphenyl)-4,6-bis(2-phenylphenyl)benzene-1,3,5-triol
CID 142403071
1,2-di(cyclohexa-2,4-dien-1-yl)-1H-indene
CID 142749479
1-cyclohexa-2,4-dien-1-yl-4-methylbenzene
CID 13139021
2-(2,3-dipropylphenyl)-1-ethyl-2,3,3a,7a-tetrahydro-1H-indene
CID 21095461
4-cyclohexa-2,4-dien-1-yl-8-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium
CID 91803021
1-cyclopropyl-2-hexylbenzene
CID 172995295
N-[3-(2-methylphenyl)cyclobutyl]-2-propylaniline
CID 43687449
1-benzyl-4-(2-propylphenyl)piperidine
CID 143140323
2-(2,3-dipropylphenyl)-1-propyl-2,3,3a,7a-tetrahydro-1H-indene
CID 21095740
N,N-dimethyl-1-(2-propylphenyl)methanamine
CID 12709346

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene?
The IUPAC name of 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene (CID 156826957) is 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene.
What is the SMILES notation for 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene?
The canonical SMILES for 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene is CCCc1ccccc1C1C=CC=CC1.
What is the InChIKey of 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene?
The InChIKey is DYQXMKPXVVKYQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-2-8-13-11-6-7-12-15(13)14-9-4-3-5-10-14/h3-7,9,11-12,14H,2,8,10H2,1H3.
What are the key properties of 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene?
1-cyclohexa-2,4-dien-1-yl-2-propylbenzene has a molecular weight of 198.31 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-2,4-dien-1-yl-2-propylbenzene is sourced from PubChem (CID 156826957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).