2-(N-butylanilino)-1-(4-methylphenyl)ethanol

C19H25NO — CID 64585032

IUPAC2-(N-butylanilino)-1-(4-methylphenyl)ethanol
SMILESCCCCN(CC(O)c1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-14-20(18-8-6-5-7-9-18)15-19(21)17-12-10-16(2)11-13-17/h5-13,19,21H,3-4,14-15H2,1-2H3
InChIKeyGZVLTXFLFODJNJ-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.34
Rot. Bonds7

About 2-(N-butylanilino)-1-(4-methylphenyl)ethanol

2-(N-butylanilino)-1-(4-methylphenyl)ethanol (PubChem CID 64585032) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(N-butylanilino)-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(N-butylanilino)-1-(4-methylphenyl)ethanol
PubChem CID64585032
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(N-butylanilino)-1-(4-methylphenyl)ethanol
SMILESCCCCN(CC(O)c1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-14-20(18-8-6-5-7-9-18)15-19(21)17-12-10-16(2)11-13-17/h5-13,19,21H,3-4,14-15H2,1-2H3
InChIKeyGZVLTXFLFODJNJ-UHFFFAOYSA-N
XLogP4.34
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(N-butylanilino)butan-2-ol
CID 63102235
1-N-butyl-1-N-phenylpropane-1,2-diamine
CID 64584797
N-butyl-N-(2-methylpentyl)aniline
CID 23123551
1-[4-[butyl(ethyl)amino]phenyl]propan-1-ol
CID 114066751
N'-butyl-N'-phenyl-2-propan-2-ylpropane-1,3-diamine
CID 65233155
3-(N-ethyl-4-methylanilino)-1-phenylpropan-1-ol
CID 62613271
3-(N-methylanilino)-1-(4-methylphenyl)propan-1-ol
CID 62617951
N,N-dibutylaniline;perchloric acid
CID 71443116
2-(dipropylamino)-1-(4-phenylphenyl)ethanol
CID 82215884
1-(N-butylanilino)-3-(cyclopropylamino)propan-2-ol
CID 64585186
[4-(dibutylamino)phenyl]-triphenylphosphanium
CID 102170052
N,N-di(nonyl)aniline
CID 22637953

Frequently Asked Questions

What is the IUPAC name of 2-(N-butylanilino)-1-(4-methylphenyl)ethanol?
The IUPAC name of 2-(N-butylanilino)-1-(4-methylphenyl)ethanol (CID 64585032) is 2-(N-butylanilino)-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 2-(N-butylanilino)-1-(4-methylphenyl)ethanol?
The canonical SMILES for 2-(N-butylanilino)-1-(4-methylphenyl)ethanol is CCCCN(CC(O)c1ccc(C)cc1)c1ccccc1.
What is the InChIKey of 2-(N-butylanilino)-1-(4-methylphenyl)ethanol?
The InChIKey is GZVLTXFLFODJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-4-14-20(18-8-6-5-7-9-18)15-19(21)17-12-10-16(2)11-13-17/h5-13,19,21H,3-4,14-15H2,1-2H3.
What are the key properties of 2-(N-butylanilino)-1-(4-methylphenyl)ethanol?
2-(N-butylanilino)-1-(4-methylphenyl)ethanol has a molecular weight of 283.42 g/mol, XLogP of 4.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-butylanilino)-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 64585032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).