N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide

C23H34N2O2 — CID 70392592

IUPACN-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide
SMILESCCCCNCC.CCc1cccc(NC(=O)COCc2ccccc2)c1
InChIInChI=1S/C17H19NO2.C6H15N/c1-2-14-9-6-10-16(11-14)18-17(19)13-20-12-15-7-4-3-5-8-15;1-3-5-6-7-4-2/h3-11H,2,12-13H2,1H3,(H,18,19);7H,3-6H2,1-2H3
InChIKeyFDPYKRBITOGSDZ-UHFFFAOYSA-N
MW370.54 g/mol
LogP4.80
Rot. Bonds10

About N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide

N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide (PubChem CID 70392592) has the molecular formula C23H34N2O2 and a molecular weight of 370.54 g/mol. Its IUPAC name is N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide
PubChem CID70392592
Molecular FormulaC23H34N2O2
Molecular Weight370.54 g/mol
Exact Mass370.26
IUPAC NameN-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide
SMILESCCCCNCC.CCc1cccc(NC(=O)COCc2ccccc2)c1
InChIInChI=1S/C17H19NO2.C6H15N/c1-2-14-9-6-10-16(11-14)18-17(19)13-20-12-15-7-4-3-5-8-15;1-3-5-6-7-4-2/h3-11H,2,12-13H2,1H3,(H,18,19);7H,3-6H2,1-2H3
InChIKeyFDPYKRBITOGSDZ-UHFFFAOYSA-N
XLogP4.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.54
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-ethylphenyl)-2-phenylmethoxyacetamide;2-methyl-N-propylpropan-2-amine
CID 70392482
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
N-butyl-2-phenylmethoxyacetamide
CID 126717674
N-(3-ethylphenyl)acetamide;N-propylbutan-1-amine
CID 70391748
3-[(2-phenylmethoxyacetyl)amino]benzoic acid
CID 43238383
N-ethylbutan-1-amine;N-(3-ethylphenyl)formamide
CID 88630078
(3-ethylphenyl)urea;N-propylbutan-1-amine
CID 70474371
N-(3-ethylphenyl)decanamide
CID 4053743
2-chloro-N-(3-ethylphenyl)acetamide
CID 2384588
N-(3-ethylphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78770107
N-butyl-2-[2-[2-(3-ethylanilino)-2-oxoethoxy]ethoxy]acetamide;N-butyl-2-[2-[2-oxo-2-[4-(4-prop-1-enylphenyl)anilino]ethoxy]ethoxy]acetamide
CID 160658755
N-[3-(bromomethyl)phenyl]-2-propoxyacetamide
CID 107941211

Frequently Asked Questions

What is the IUPAC name of N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide?
The IUPAC name of N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide (CID 70392592) is N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide.
What is the SMILES notation for N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide?
The canonical SMILES for N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide is CCCCNCC.CCc1cccc(NC(=O)COCc2ccccc2)c1.
What is the InChIKey of N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide?
The InChIKey is FDPYKRBITOGSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2.C6H15N/c1-2-14-9-6-10-16(11-14)18-17(19)13-20-12-15-7-4-3-5-8-15;1-3-5-6-7-4-2/h3-11H,2,12-13H2,1H3,(H,18,19);7H,3-6H2,1-2H3.
What are the key properties of N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide?
N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide has a molecular weight of 370.54 g/mol, XLogP of 4.80, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylbutan-1-amine;N-(3-ethylphenyl)-2-phenylmethoxyacetamide is sourced from PubChem (CID 70392592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).