N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide

C15H25N3O2 — CID 43269237

IUPACN-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide
SMILESCCCN(CC(=O)Nc1cc(N)ccc1OC)C(C)C
InChIInChI=1S/C15H25N3O2/c1-5-8-18(11(2)3)10-15(19)17-13-9-12(16)6-7-14(13)20-4/h6-7,9,11H,5,8,10,16H2,1-4H3,(H,17,19)
InChIKeyMPKNVSJIVKASAN-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.34
Rot. Bonds7

About N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide

N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide (PubChem CID 43269237) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide
PubChem CID43269237
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide
SMILESCCCN(CC(=O)Nc1cc(N)ccc1OC)C(C)C
InChIInChI=1S/C15H25N3O2/c1-5-8-18(11(2)3)10-15(19)17-13-9-12(16)6-7-14(13)20-4/h6-7,9,11H,5,8,10,16H2,1-4H3,(H,17,19)
InChIKeyMPKNVSJIVKASAN-UHFFFAOYSA-N
XLogP2.34
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-amino-2-methoxyphenyl)-2-[ethyl(propyl)amino]propanamide
CID 43268403
N-(5-amino-2-methoxyphenyl)-4-[methyl(propan-2-yl)amino]butanamide
CID 16785339
N-(5-amino-2-methoxyphenyl)-3-propan-2-ylsulfonylpropanamide
CID 60884523
N-(5-amino-2-methoxyphenyl)-2-pentylsulfonylacetamide
CID 107751430
N-(5-amino-2-methoxyphenyl)-2-ethoxypropanamide
CID 16783991
N-(5-amino-2-methoxyphenyl)-4-[1-hydroxypropan-2-yl(methyl)amino]butanamide
CID 104551240
N-(2-amino-4-fluorophenyl)-2-[propan-2-yl(propyl)amino]acetamide
CID 43269222
N-(5-amino-2-methoxyphenyl)-2-[bis(cyanomethyl)amino]acetamide
CID 18070557
N-(5-amino-2-methoxyphenyl)-2-pentoxyacetamide
CID 43275007
N-(5-amino-2-methoxyphenyl)-2-methylpropanamide
CID 16772178
N-(5-amino-2-methoxyphenyl)-2-(3-methylbutan-2-ylsulfanyl)acetamide
CID 107748768
N-(5-amino-2-methoxyphenyl)-2-(2-methylbutylsulfinyl)acetamide
CID 107753805

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide?
The IUPAC name of N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide (CID 43269237) is N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide.
What is the SMILES notation for N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide?
The canonical SMILES for N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide is CCCN(CC(=O)Nc1cc(N)ccc1OC)C(C)C.
What is the InChIKey of N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide?
The InChIKey is MPKNVSJIVKASAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-8-18(11(2)3)10-15(19)17-13-9-12(16)6-7-14(13)20-4/h6-7,9,11H,5,8,10,16H2,1-4H3,(H,17,19).
What are the key properties of N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide?
N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide has a molecular weight of 279.38 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methoxyphenyl)-2-[propan-2-yl(propyl)amino]acetamide is sourced from PubChem (CID 43269237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).