5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide

C15H24N2O2 — CID 104684604

IUPAC5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide
SMILESCC(CCCN)C(=O)N(C)C(C)c1ccccc1O
InChIInChI=1S/C15H24N2O2/c1-11(7-6-10-16)15(19)17(3)12(2)13-8-4-5-9-14(13)18/h4-5,8-9,11-12,18H,6-7,10,16H2,1-3H3
InChIKeyRDVHVBPYEGERDP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.29
Rot. Bonds6

About 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide

5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide (PubChem CID 104684604) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide.

Molecular Properties

Compound Name5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide
PubChem CID104684604
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide
SMILESCC(CCCN)C(=O)N(C)C(C)c1ccccc1O
InChIInChI=1S/C15H24N2O2/c1-11(7-6-10-16)15(19)17(3)12(2)13-8-4-5-9-14(13)18/h4-5,8-9,11-12,18H,6-7,10,16H2,1-3H3
InChIKeyRDVHVBPYEGERDP-UHFFFAOYSA-N
XLogP2.29
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-[1-(2-methoxyphenyl)ethyl]-N,2-dimethylpentanamide
CID 104684407
(2S)-2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbutanamide
CID 79024859
(2R)-2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,3,3-trimethylbutanamide
CID 103929396
2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,3,3-trimethylbutanamide
CID 76894927
2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-phenylacetamide
CID 60953156
4-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,3-dimethylbutanamide
CID 81087863
N-[1-(2-hydroxyphenyl)ethyl]-N-methylpentanamide
CID 54916026
6-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,4,4-trimethylhexanamide
CID 65292237
1-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methylcyclopentane-1-carboxamide
CID 54874342
methyl N-[1-(2-hydroxyphenyl)ethyl]-N-methylcarbamate
CID 61044422
2-hydroxy-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61042835
N-[1-(2-hydroxyphenyl)ethyl]-N-methylpiperidine-1-carboxamide
CID 112725664

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide?
The IUPAC name of 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide (CID 104684604) is 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide.
What is the SMILES notation for 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide?
The canonical SMILES for 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide is CC(CCCN)C(=O)N(C)C(C)c1ccccc1O.
What is the InChIKey of 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide?
The InChIKey is RDVHVBPYEGERDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(7-6-10-16)15(19)17(3)12(2)13-8-4-5-9-14(13)18/h4-5,8-9,11-12,18H,6-7,10,16H2,1-3H3.
What are the key properties of 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide?
5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide has a molecular weight of 264.37 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,2-dimethylpentanamide is sourced from PubChem (CID 104684604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).