2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide

C14H23N3O2 — CID 81082598

IUPAC2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)Nc1ccc(N(C)C)cc1
InChIInChI=1S/C14H23N3O2/c1-17(2)12-8-6-11(7-9-12)16-14(18)13(15)5-4-10-19-3/h6-9,13H,4-5,10,15H2,1-3H3,(H,16,18)
InChIKeyCLDRDLLXYWYXFK-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.45
Rot. Bonds7

About 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide

2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide (PubChem CID 81082598) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide
PubChem CID81082598
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)Nc1ccc(N(C)C)cc1
InChIInChI=1S/C14H23N3O2/c1-17(2)12-8-6-11(7-9-12)16-14(18)13(15)5-4-10-19-3/h6-9,13H,4-5,10,15H2,1-3H3,(H,16,18)
InChIKeyCLDRDLLXYWYXFK-UHFFFAOYSA-N
XLogP1.45
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

methyl N-[4-[(2-amino-5-methoxypentanoyl)amino]phenyl]carbamate
CID 81071019
methyl 4-[(2-amino-5-methoxypentanoyl)amino]benzoate
CID 81089380
2-amino-5-methoxy-N-[4-(propanoylamino)phenyl]pentanamide
CID 81086454
2-amino-N-[[4-(dimethylamino)phenyl]methyl]-5-methoxypentanamide
CID 81088409
2-amino-5-methoxy-N-naphthalen-2-ylpentanamide
CID 81083067
2-amino-N-(4-hydroxyphenyl)-4-methoxybutanamide
CID 62472832
2-amino-5-methoxy-N-pyrimidin-5-ylpentanamide
CID 107588458
2-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methoxypentanamide
CID 81086085
2-amino-5-methoxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pentanamide
CID 81082977
2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
CID 119289402
2-amino-5-methoxy-N-(3-pyrrol-1-ylphenyl)pentanamide
CID 81071300
2-amino-N-(2-hydroxyphenyl)-5-methoxypentanamide
CID 81089431

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide?
The IUPAC name of 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide (CID 81082598) is 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide is COCCCC(N)C(=O)Nc1ccc(N(C)C)cc1.
What is the InChIKey of 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide?
The InChIKey is CLDRDLLXYWYXFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-17(2)12-8-6-11(7-9-12)16-14(18)13(15)5-4-10-19-3/h6-9,13H,4-5,10,15H2,1-3H3,(H,16,18).
What are the key properties of 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide?
2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide has a molecular weight of 265.36 g/mol, XLogP of 1.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(dimethylamino)phenyl]-5-methoxypentanamide is sourced from PubChem (CID 81082598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).