1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine

C20H29N — CID 91443625

IUPAC1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine
SMILESCCc1ccc(CCCc2ccc(CC)cc2)cc1.CN
InChIInChI=1S/C19H24.CH5N/c1-3-16-8-12-18(13-9-16)6-5-7-19-14-10-17(4-2)11-15-19;1-2/h8-15H,3-7H2,1-2H3;2H2,1H3
InChIKeyDXLNWDSFUVNQQT-UHFFFAOYSA-N
MW283.46 g/mol
LogP4.56
Rot. Bonds6

About 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine

1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine (PubChem CID 91443625) has the molecular formula C20H29N and a molecular weight of 283.46 g/mol. Its IUPAC name is 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine.

Molecular Properties

Compound Name1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine
PubChem CID91443625
Molecular FormulaC20H29N
Molecular Weight283.46 g/mol
Exact Mass283.23
IUPAC Name1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine
SMILESCCc1ccc(CCCc2ccc(CC)cc2)cc1.CN
InChIInChI=1S/C19H24.CH5N/c1-3-16-8-12-18(13-9-16)6-5-7-19-14-10-17(4-2)11-15-19;1-2/h8-15H,3-7H2,1-2H3;2H2,1H3
InChIKeyDXLNWDSFUVNQQT-UHFFFAOYSA-N
XLogP4.56
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-4-[2-[4-[2-[4-[2-[4-[2-[4-[2-(4-ethylphenyl)ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]benzene
CID 102370536
1-ethyl-4-octacosylbenzene
CID 175218304
ethane;4-(4-ethylphenyl)butanamide
CID 142203218
1-butyl-4-(4-ethylphenyl)benzene;ethane
CID 145367281
1,4-diethylbenzene;ethane
CID 91207141
alumane;1,4-diethylbenzene
CID 174296012
1-ethyl-4-(4-methoxybutyl)benzene
CID 143010325
6-(4-ethylphenyl)-N-methylhexan-1-amine
CID 65308799
1-butyl-4-methylbenzene;1-ethyl-4-methylbenzene;1-methyl-4-propylbenzene
CID 159106327
1-ethyl-4-hex-5-ynylbenzene
CID 90962288
1,4-diethylbenzene;ethane;methane
CID 166131756
1,4-diethylbenzene;heptane
CID 175370860

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine?
The IUPAC name of 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine (CID 91443625) is 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine.
What is the SMILES notation for 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine?
The canonical SMILES for 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine is CCc1ccc(CCCc2ccc(CC)cc2)cc1.CN.
What is the InChIKey of 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine?
The InChIKey is DXLNWDSFUVNQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24.CH5N/c1-3-16-8-12-18(13-9-16)6-5-7-19-14-10-17(4-2)11-15-19;1-2/h8-15H,3-7H2,1-2H3;2H2,1H3.
What are the key properties of 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine?
1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine has a molecular weight of 283.46 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[3-(4-ethylphenyl)propyl]benzene;methanamine is sourced from PubChem (CID 91443625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).