2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide

C15H23N3O3 — CID 60848779

IUPAC2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1ccc(NC(=O)COC)cc1
InChIInChI=1S/C15H23N3O3/c1-4-9-15(2,16)14(20)18-12-7-5-11(6-8-12)17-13(19)10-21-3/h5-8H,4,9-10,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyURNBRLOGDBCVNK-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.73
Rot. Bonds7

About 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide

2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide (PubChem CID 60848779) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide
PubChem CID60848779
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1ccc(NC(=O)COC)cc1
InChIInChI=1S/C15H23N3O3/c1-4-9-15(2,16)14(20)18-12-7-5-11(6-8-12)17-13(19)10-21-3/h5-8H,4,9-10,16H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyURNBRLOGDBCVNK-UHFFFAOYSA-N
XLogP1.73
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-[4-[(2-amino-2-methylpentanoyl)amino]phenyl]carbamate
CID 60848240
2-amino-2-methyl-N-[4-(propanoylamino)phenyl]pentanamide;hydrochloride
CID 119735835
4-[(2-amino-2-methylpentanoyl)amino]benzoic acid
CID 61156660
2-amino-2-methyl-N-(4-methylsulfanylphenyl)pentanamide
CID 60848568
2-amino-N-(4-butylphenyl)-2-methylpentanamide
CID 54928789
2-(tert-butylamino)-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 47842254
2-amino-N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpentanamide;hydrochloride
CID 119739656
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
4-[(2-amino-2-methylpentanoyl)amino]-N-propylbenzamide;hydrochloride
CID 119739022
2-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methylpentanamide
CID 60928090
2-amino-N-[4-(1,3-dioxolan-2-yl)phenyl]-2-methylpentanamide
CID 106911813

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide?
The IUPAC name of 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide (CID 60848779) is 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide?
The canonical SMILES for 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide is CCCC(C)(N)C(=O)Nc1ccc(NC(=O)COC)cc1.
What is the InChIKey of 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide?
The InChIKey is URNBRLOGDBCVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-4-9-15(2,16)14(20)18-12-7-5-11(6-8-12)17-13(19)10-21-3/h5-8H,4,9-10,16H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide?
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide has a molecular weight of 293.37 g/mol, XLogP of 1.73, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide is sourced from PubChem (CID 60848779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).