2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide

C14H22N2O2 — CID 62472432

IUPAC2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide
SMILESCCN(C(=O)C(N)CCOC)c1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)12(15)9-10-18-3/h5-8,12H,4,9-10,15H2,1-3H3
InChIKeyPXMPLFRPPVYVNR-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.71
Rot. Bonds6

About 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide

2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide (PubChem CID 62472432) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide
PubChem CID62472432
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide
SMILESCCN(C(=O)C(N)CCOC)c1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)12(15)9-10-18-3/h5-8,12H,4,9-10,15H2,1-3H3
InChIKeyPXMPLFRPPVYVNR-UHFFFAOYSA-N
XLogP1.71
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-ethyl-N-(2-methylphenyl)-3-phenylpropanamide
CID 61148945
2-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylpropanamide
CID 81082117
N-ethyl-2,2-difluoro-N-(2-methylphenyl)acetamide
CID 103515266
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
N-ethyl-2-methyl-N-(2-methylphenyl)pentanamide
CID 2890658
2-amino-N-ethyl-5-methoxy-N-(3-methylphenyl)pentanamide
CID 81088935
N,N'-diethyl-N,N'-bis(2-methylphenyl)-2-phenylpropanediamide
CID 3396233
3-(N-ethyl-2-methylanilino)-2-methyl-3-oxopropanoic acid
CID 114896860
2-amino-1-(2,3-dimethylphenyl)-4-methoxybutan-1-one
CID 116567259
3-(N-[(2S)-2-aminobutanoyl]-2-methylanilino)propanoic acid
CID 79023548
4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide
CID 103154153
4-(N-(2-amino-4-methoxybutanoyl)anilino)butanoic acid
CID 62473233

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide?
The IUPAC name of 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide (CID 62472432) is 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide.
What is the SMILES notation for 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide?
The canonical SMILES for 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide is CCN(C(=O)C(N)CCOC)c1ccccc1C.
What is the InChIKey of 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide?
The InChIKey is PXMPLFRPPVYVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)12(15)9-10-18-3/h5-8,12H,4,9-10,15H2,1-3H3.
What are the key properties of 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide?
2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide has a molecular weight of 250.34 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide is sourced from PubChem (CID 62472432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).