2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole

C14H17P — CID 175179195

IUPAC2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole
SMILESCc1cc(CCc2ccccc2)c(C)[pH]1
InChIInChI=1S/C14H17P/c1-11-10-14(12(2)15-11)9-8-13-6-4-3-5-7-13/h3-7,10,15H,8-9H2,1-2H3
InChIKeyOJBAEYKFRZQXAP-UHFFFAOYSA-N
MW216.26 g/mol
LogP4.12
Rot. Bonds3

About 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole

2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole (PubChem CID 175179195) has the molecular formula C14H17P and a molecular weight of 216.26 g/mol. Its IUPAC name is 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole.

Molecular Properties

Compound Name2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole
PubChem CID175179195
Molecular FormulaC14H17P
Molecular Weight216.26 g/mol
Exact Mass216.11
IUPAC Name2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole
SMILESCc1cc(CCc2ccccc2)c(C)[pH]1
InChIInChI=1S/C14H17P/c1-11-10-14(12(2)15-11)9-8-13-6-4-3-5-7-13/h3-7,10,15H,8-9H2,1-2H3
InChIKeyOJBAEYKFRZQXAP-UHFFFAOYSA-N
XLogP4.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

benzene;2-phenylethylbenzene
CID 18982764
ethane;methane;2-phenylethylbenzene
CID 158652330
1-[2-(3,5-dimethylphenyl)ethyl]-3,5-dimethylbenzene;2-phenylethylbenzene
CID 173107098
2-methyl-1-(2-phenylethyl)-4-(trifluoromethyl)benzene
CID 91426393
1-methyl-2-(2-phenylethyl)-4-propan-2-ylbenzene
CID 142112281
2,4-dimethyl-1-(2-phenylethyl)benzene;gold
CID 173364905
hafnium;2-phenylethylbenzene
CID 173109801
4-fluoro-2-methyl-1-(2-phenylethyl)benzene
CID 90778447
1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene
CID 102449129
[4-methyl-3-(2-phenylethyl)phenyl]methanamine
CID 134425806
alumane;2-phenylethylbenzene;hydrobromide
CID 173446278
2,6-dichloro-3-methyl-5-(2-phenylethyl)pyridine
CID 15154275

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole?
The IUPAC name of 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole (CID 175179195) is 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole.
What is the SMILES notation for 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole?
The canonical SMILES for 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole is Cc1cc(CCc2ccccc2)c(C)[pH]1.
What is the InChIKey of 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole?
The InChIKey is OJBAEYKFRZQXAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17P/c1-11-10-14(12(2)15-11)9-8-13-6-4-3-5-7-13/h3-7,10,15H,8-9H2,1-2H3.
What are the key properties of 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole?
2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole has a molecular weight of 216.26 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-(2-phenylethyl)-1H-phosphole is sourced from PubChem (CID 175179195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).