N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide

C15H24N2O2 — CID 55053195

IUPACN-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(C(C)NCCCCCO)c1
InChIInChI=1S/C15H24N2O2/c1-12(16-9-4-3-5-10-18)14-7-6-8-15(11-14)17-13(2)19/h6-8,11-12,16,18H,3-5,9-10H2,1-2H3,(H,17,19)
InChIKeyZODGBSGCDMUVPX-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.46
Rot. Bonds8

About N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide

N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide (PubChem CID 55053195) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide
PubChem CID55053195
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(C(C)NCCCCCO)c1
InChIInChI=1S/C15H24N2O2/c1-12(16-9-4-3-5-10-18)14-7-6-8-15(11-14)17-13(2)19/h6-8,11-12,16,18H,3-5,9-10H2,1-2H3,(H,17,19)
InChIKeyZODGBSGCDMUVPX-UHFFFAOYSA-N
XLogP2.46
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 4-[1-(3-acetamidophenyl)ethylamino]butanoate
CID 60782458
N-[3-[1-(3-ethylsulfanylpropylamino)ethyl]phenyl]acetamide
CID 115900103
N-[3-[1-(3-ethoxypropylamino)ethyl]phenyl]acetamide
CID 43201568
N-[3-[1-[3-(2-methoxyethoxy)propylamino]ethyl]phenyl]acetamide
CID 43206933
N-[3-[1-(3-propoxypropylamino)ethyl]phenyl]acetamide
CID 82940339
5-[1-(3-methylphenyl)ethylamino]pentan-1-ol
CID 107303118
5-[[(1R)-1-(3-methylphenyl)ethyl]amino]pentan-1-ol
CID 81360778
N-[3-[1-[2-(2-methylpropoxy)ethylamino]ethyl]phenyl]acetamide
CID 115713617
N-[3-[1-(3-methylsulfinylbutylamino)ethyl]phenyl]acetamide
CID 115894505
N-[3-[1-(2-ethylsulfinylethylamino)ethyl]phenyl]acetamide
CID 115718801
N-[3-[1-(but-2-ynylamino)ethyl]phenyl]acetamide
CID 62309945
N-[3-[1-[2-(3-methoxypropoxy)ethylamino]ethyl]phenyl]acetamide
CID 103178645

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide?
The IUPAC name of N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide (CID 55053195) is N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide?
The canonical SMILES for N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide is CC(=O)Nc1cccc(C(C)NCCCCCO)c1.
What is the InChIKey of N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide?
The InChIKey is ZODGBSGCDMUVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(16-9-4-3-5-10-18)14-7-6-8-15(11-14)17-13(2)19/h6-8,11-12,16,18H,3-5,9-10H2,1-2H3,(H,17,19).
What are the key properties of N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide?
N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.46, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(5-hydroxypentylamino)ethyl]phenyl]acetamide is sourced from PubChem (CID 55053195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).