1-propyl-4-[(4-propylphenyl)methyl]benzene

C19H24 — CID 4064340

IUPAC1-propyl-4-[(4-propylphenyl)methyl]benzene
SMILESCCCc1ccc(Cc2ccc(CCC)cc2)cc1
InChIInChI=1S/C19H24/c1-3-5-16-7-11-18(12-8-16)15-19-13-9-17(6-4-2)10-14-19/h7-14H,3-6,15H2,1-2H3
InChIKeyHITJOTREZGQONI-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.18
Rot. Bonds6

About 1-propyl-4-[(4-propylphenyl)methyl]benzene

1-propyl-4-[(4-propylphenyl)methyl]benzene (PubChem CID 4064340) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-propyl-4-[(4-propylphenyl)methyl]benzene.

Molecular Properties

Compound Name1-propyl-4-[(4-propylphenyl)methyl]benzene
PubChem CID4064340
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Name1-propyl-4-[(4-propylphenyl)methyl]benzene
SMILESCCCc1ccc(Cc2ccc(CCC)cc2)cc1
InChIInChI=1S/C19H24/c1-3-5-16-7-11-18(12-8-16)15-19-13-9-17(6-4-2)10-14-19/h7-14H,3-6,15H2,1-2H3
InChIKeyHITJOTREZGQONI-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.40
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

N-methyl-4-[(4-propylphenyl)methyl]aniline
CID 116926083
1-methoxy-4-[(4-propylphenyl)methyl]benzene
CID 67608407
1,4-bis[(4-butylphenyl)methyl]benzene
CID 58021495
1-butyl-4-[(4-butylphenyl)methyl]benzene
CID 57156341
1,4-bis[(4-butylphenyl)methyl]benzene;ethane
CID 91530011
1-prop-1-en-2-yl-4-[(4-propylphenyl)methyl]benzene
CID 153374408
N-methyl-1-(4-propylphenyl)methanamine
CID 20666221
3-[(4-propylphenyl)methyl]phenol
CID 67607655
1-fluoro-4-propylbenzene
CID 2737505
ethane;N-methyl-1-(4-propylphenyl)methanamine
CID 176699852
ethane;N-methyl-2-(4-propylphenyl)ethanamine
CID 143565028
methyl 3-[4-[(4-propylphenyl)methyl]phenyl]propanoate
CID 159099314

Frequently Asked Questions

What is the IUPAC name of 1-propyl-4-[(4-propylphenyl)methyl]benzene?
The IUPAC name of 1-propyl-4-[(4-propylphenyl)methyl]benzene (CID 4064340) is 1-propyl-4-[(4-propylphenyl)methyl]benzene.
What is the SMILES notation for 1-propyl-4-[(4-propylphenyl)methyl]benzene?
The canonical SMILES for 1-propyl-4-[(4-propylphenyl)methyl]benzene is CCCc1ccc(Cc2ccc(CCC)cc2)cc1.
What is the InChIKey of 1-propyl-4-[(4-propylphenyl)methyl]benzene?
The InChIKey is HITJOTREZGQONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-3-5-16-7-11-18(12-8-16)15-19-13-9-17(6-4-2)10-14-19/h7-14H,3-6,15H2,1-2H3.
What are the key properties of 1-propyl-4-[(4-propylphenyl)methyl]benzene?
1-propyl-4-[(4-propylphenyl)methyl]benzene has a molecular weight of 252.40 g/mol, XLogP of 5.18, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-4-[(4-propylphenyl)methyl]benzene is sourced from PubChem (CID 4064340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).