4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide

C14H22N2O2 — CID 103154153

IUPAC4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide
SMILESCCN(C(=O)CC(CN)OC)c1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)9-12(10-15)18-3/h5-8,12H,4,9-10,15H2,1-3H3
InChIKeyNCCNXERADRYGCO-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.71
Rot. Bonds6

About 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide

4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide (PubChem CID 103154153) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide
PubChem CID103154153
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide
SMILESCCN(C(=O)CC(CN)OC)c1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)9-12(10-15)18-3/h5-8,12H,4,9-10,15H2,1-3H3
InChIKeyNCCNXERADRYGCO-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

4-amino-N-ethyl-3-methoxy-N-naphthalen-1-ylbutanamide
CID 103154156
4-amino-N-ethyl-3-methoxy-N-[(2-methylphenyl)methyl]butanamide;hydrochloride
CID 120588742
2-(1-aminopropan-2-ylsulfanyl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 66220592
4-amino-N-ethyl-N-(3-hydroxyphenyl)-3-methoxybutanamide
CID 107735030
2-methoxy-N'-methyl-N'-(2-methylphenyl)butane-1,4-diamine
CID 103152435
2-(2-aminophenyl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 18070776
N-(2-aminophenyl)-N-ethyl-2-(2-methylphenyl)acetamide
CID 62100818
methyl 3-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]propanoate
CID 62013232
2-amino-N-ethyl-4-methoxy-N-(2-methylphenyl)butanamide
CID 62472432
N-ethyl-2,2-difluoro-N-(2-methylphenyl)acetamide
CID 103515266
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
N-ethyl-N-(2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 3610846

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide?
The IUPAC name of 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide (CID 103154153) is 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide.
What is the SMILES notation for 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide?
The canonical SMILES for 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide is CCN(C(=O)CC(CN)OC)c1ccccc1C.
What is the InChIKey of 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide?
The InChIKey is NCCNXERADRYGCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-16(13-8-6-5-7-11(13)2)14(17)9-12(10-15)18-3/h5-8,12H,4,9-10,15H2,1-3H3.
What are the key properties of 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide?
4-amino-N-ethyl-3-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 4-amino-N-ethyl-3-methoxy-N-(2-methylphenyl)butanamide is sourced from PubChem (CID 103154153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).