N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide

C15H24N2O2 — CID 82985461

IUPACN-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCc1cc(N)ccc1O
InChIInChI=1S/C15H24N2O2/c1-3-5-11(6-4-2)15(19)17-10-12-9-13(16)7-8-14(12)18/h7-9,11,18H,3-6,10,16H2,1-2H3,(H,17,19)
InChIKeyOFOLWUUHJAAKNO-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.81
Rot. Bonds7

About N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide

N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide (PubChem CID 82985461) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide.

Molecular Properties

Compound NameN-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide
PubChem CID82985461
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCc1cc(N)ccc1O
InChIInChI=1S/C15H24N2O2/c1-3-5-11(6-4-2)15(19)17-10-12-9-13(16)7-8-14(12)18/h7-9,11,18H,3-6,10,16H2,1-2H3,(H,17,19)
InChIKeyOFOLWUUHJAAKNO-UHFFFAOYSA-N
XLogP2.81
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(5-amino-2-hydroxyphenyl)methyl]propanamide
CID 43548596
N-[(5-amino-2-hydroxyphenyl)methyl]octanamide
CID 43548602
N-[(5-amino-2-hydroxyphenyl)methyl]-2-hydroxybenzamide
CID 43548729
N-[(5-amino-2-hydroxyphenyl)methyl]-3-hydroxy-2-methylbenzamide
CID 82827346
N-[(5-amino-2-hydroxyphenyl)methyl]-4-bromobenzamide
CID 43548733
N-[(5-amino-2-hydroxyphenyl)methyl]pyridine-4-carboxamide
CID 43548732
N-[(5-amino-2-hydroxyphenyl)methyl]-2-hydroxy-3-methylbenzamide
CID 43548627
N-[(5-amino-2-hydroxyphenyl)methyl]-5-methylfuran-2-carboxamide
CID 43548614
N-[(5-amino-2-hydroxyphenyl)methyl]-2-hydroxy-5-iodobenzamide
CID 107731132
N-[(5-amino-2-hydroxyphenyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
CID 65151478
N-[[4-(aminomethyl)phenyl]methyl]-2-propylpentanamide
CID 82984622
N-[[3-(hydroxymethyl)phenyl]methyl]-2-propylpentanamide
CID 115532885

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide?
The IUPAC name of N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide (CID 82985461) is N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide.
What is the SMILES notation for N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide?
The canonical SMILES for N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide is CCCC(CCC)C(=O)NCc1cc(N)ccc1O.
What is the InChIKey of N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide?
The InChIKey is OFOLWUUHJAAKNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-5-11(6-4-2)15(19)17-10-12-9-13(16)7-8-14(12)18/h7-9,11,18H,3-6,10,16H2,1-2H3,(H,17,19).
What are the key properties of N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide?
N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide has a molecular weight of 264.37 g/mol, XLogP of 2.81, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-2-hydroxyphenyl)methyl]-2-propylpentanamide is sourced from PubChem (CID 82985461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).