3-[1-(1-phenylpentylamino)ethyl]phenol

C19H25NO — CID 43791599

IUPAC3-[1-(1-phenylpentylamino)ethyl]phenol
SMILESCCCCC(NC(C)c1cccc(O)c1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-13-19(16-9-6-5-7-10-16)20-15(2)17-11-8-12-18(21)14-17/h5-12,14-15,19-21H,3-4,13H2,1-2H3
InChIKeyGOHXHLHVBVNCPD-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.97
Rot. Bonds7

About 3-[1-(1-phenylpentylamino)ethyl]phenol

3-[1-(1-phenylpentylamino)ethyl]phenol (PubChem CID 43791599) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 3-[1-(1-phenylpentylamino)ethyl]phenol.

Molecular Properties

Compound Name3-[1-(1-phenylpentylamino)ethyl]phenol
PubChem CID43791599
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name3-[1-(1-phenylpentylamino)ethyl]phenol
SMILESCCCCC(NC(C)c1cccc(O)c1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-13-19(16-9-6-5-7-10-16)20-15(2)17-11-8-12-18(21)14-17/h5-12,14-15,19-21H,3-4,13H2,1-2H3
InChIKeyGOHXHLHVBVNCPD-UHFFFAOYSA-N
XLogP4.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(3-chlorophenyl)ethyl]-1-phenylpentan-1-amine
CID 81361767
3-[1-[1-(4-bromophenyl)propylamino]ethyl]phenol
CID 43692345
1-phenyl-N-[(1S)-1-pyridin-4-ylethyl]hexan-1-amine
CID 81395700
N-[(1R)-1-(3-fluorophenyl)ethyl]-1-phenylbutan-1-amine
CID 81369195
2,4-dimethyl-N-(1-phenylpentyl)pentan-3-amine
CID 10659103
N-pentan-3-yl-1-phenylpentan-1-amine
CID 43756569
N-[1-(3-methoxyphenyl)ethyl]-1-phenylbutan-1-amine
CID 43720331
N-(1-phenylpentyl)octan-2-amine
CID 43791089
5-[1-[(2-hydroxy-1-phenylethyl)amino]ethyl]benzene-1,3-diol
CID 107706519
3-octan-4-ylphenol
CID 54137408
N-(1-phenylethyl)hexan-2-amine
CID 43755937
(3S)-3-(3-hydroxyphenyl)-2-methylheptanoic acid
CID 67428563

Frequently Asked Questions

What is the IUPAC name of 3-[1-(1-phenylpentylamino)ethyl]phenol?
The IUPAC name of 3-[1-(1-phenylpentylamino)ethyl]phenol (CID 43791599) is 3-[1-(1-phenylpentylamino)ethyl]phenol.
What is the SMILES notation for 3-[1-(1-phenylpentylamino)ethyl]phenol?
The canonical SMILES for 3-[1-(1-phenylpentylamino)ethyl]phenol is CCCCC(NC(C)c1cccc(O)c1)c1ccccc1.
What is the InChIKey of 3-[1-(1-phenylpentylamino)ethyl]phenol?
The InChIKey is GOHXHLHVBVNCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-4-13-19(16-9-6-5-7-10-16)20-15(2)17-11-8-12-18(21)14-17/h5-12,14-15,19-21H,3-4,13H2,1-2H3.
What are the key properties of 3-[1-(1-phenylpentylamino)ethyl]phenol?
3-[1-(1-phenylpentylamino)ethyl]phenol has a molecular weight of 283.42 g/mol, XLogP of 4.97, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(1-phenylpentylamino)ethyl]phenol is sourced from PubChem (CID 43791599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).