2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide

C13H20N2O2 — CID 43179380

IUPAC2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide
SMILESCCC(C)NCC(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H20N2O2/c1-4-10(2)14-9-13(16)15-11-6-5-7-12(8-11)17-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyQIYQKFVFQPPOKJ-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.02
Rot. Bonds6

About 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide

2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide (PubChem CID 43179380) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide
PubChem CID43179380
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide
SMILESCCC(C)NCC(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H20N2O2/c1-4-10(2)14-9-13(16)15-11-6-5-7-12(8-11)17-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyQIYQKFVFQPPOKJ-UHFFFAOYSA-N
XLogP2.02
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(butan-2-ylamino)-N-(3-methoxyphenyl)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

2-(1-hydroxypropan-2-ylamino)-N-(3-methoxyphenyl)acetamide
CID 43499874
N-(3-methoxyphenyl)-2-(3-methylpentan-2-ylamino)acetamide
CID 61463325
2-[[2-(3-methoxyanilino)-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468312
2-(butan-2-ylamino)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
CID 60852115
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
2-(butan-2-ylamino)-N-(3-hydroxyphenyl)acetamide
CID 61166125
2-(butan-2-ylamino)-N-[3-[2-(dimethylamino)ethoxy]phenyl]acetamide
CID 60852855
2-(hydroxyamino)-N-(3-methoxyphenyl)acetamide
CID 12611733
N-(3-methoxyphenyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131545
N'-butan-2-yl-N-(3-methoxyphenyl)oxamide
CID 44999404
2-(butan-2-ylamino)-N-[3-(dimethylamino)phenyl]acetamide
CID 115376908
2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 9307739

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide (CID 43179380) is 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide is CCC(C)NCC(=O)Nc1cccc(OC)c1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide?
The InChIKey is QIYQKFVFQPPOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-10(2)14-9-13(16)15-11-6-5-7-12(8-11)17-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16).
What are the key properties of 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide?
2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide has a molecular weight of 236.31 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 43179380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).