1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine

C19H26N2O — CID 169384784

IUPAC1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCOc1ccc(CNNc2ccccc2)cc1C
InChIInChI=1S/C19H26N2O/c1-3-4-8-13-22-19-12-11-17(14-16(19)2)15-20-21-18-9-6-5-7-10-18/h5-7,9-12,14,20-21H,3-4,8,13,15H2,1-2H3
InChIKeyKCVKXFSARBPMPP-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.68
Rot. Bonds9

About 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine

1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine (PubChem CID 169384784) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine
PubChem CID169384784
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine
SMILESCCCCCOc1ccc(CNNc2ccccc2)cc1C
InChIInChI=1S/C19H26N2O/c1-3-4-8-13-22-19-12-11-17(14-16(19)2)15-20-21-18-9-6-5-7-10-18/h5-7,9-12,14,20-21H,3-4,8,13,15H2,1-2H3
InChIKeyKCVKXFSARBPMPP-UHFFFAOYSA-N
XLogP4.68
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[(3-chloro-4-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384780
1-[(4-fluoro-3-hexoxyphenyl)methyl]-2-phenylhydrazine
CID 169384787
1-[(5-methyl-2-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384807
1-[(3,4-difluoro-5-pentoxyphenyl)methyl]-2-phenylhydrazine
CID 169384801
1-[[3-(methoxymethyl)-4-propoxyphenyl]methyl]-2-phenylhydrazine
CID 169386185
2-methyl-1-octoxy-4-phenylbenzene
CID 23393452
2-anilino-N-[(3-methyl-4-propoxyphenyl)methyl]acetamide
CID 142694058
[2-methyl-4-[(2-phenylhydrazinyl)methyl]phenyl]boronic acid
CID 169384701
1-[(5-chloro-2-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384738
ethane;1-methyl-2-pentoxybenzene
CID 143283195
1-methyl-2-pentadecoxybenzene
CID 154641785
1-[(3,5-difluoro-4-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384890

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine (CID 169384784) is 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine is CCCCCOc1ccc(CNNc2ccccc2)cc1C.
What is the InChIKey of 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine?
The InChIKey is KCVKXFSARBPMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-3-4-8-13-22-19-12-11-17(14-16(19)2)15-20-21-18-9-6-5-7-10-18/h5-7,9-12,14,20-21H,3-4,8,13,15H2,1-2H3.
What are the key properties of 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine?
1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine has a molecular weight of 298.43 g/mol, XLogP of 4.68, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methyl-4-pentoxyphenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 169384784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).