N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine

C18H26N2O — CID 103912622

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCCc1cnc(CNC(C)c2ccc(CC(C)C)cc2)o1
InChIInChI=1S/C18H26N2O/c1-5-17-11-20-18(21-17)12-19-14(4)16-8-6-15(7-9-16)10-13(2)3/h6-9,11,13-14,19H,5,10,12H2,1-4H3
InChIKeyYZINIHXIVAAGED-UHFFFAOYSA-N
MW286.42 g/mol
LogP4.29
Rot. Bonds7

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine (PubChem CID 103912622) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine
PubChem CID103912622
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCCc1cnc(CNC(C)c2ccc(CC(C)C)cc2)o1
InChIInChI=1S/C18H26N2O/c1-5-17-11-20-18(21-17)12-19-14(4)16-8-6-15(7-9-16)10-13(2)3/h6-9,11,13-14,19H,5,10,12H2,1-4H3
InChIKeyYZINIHXIVAAGED-UHFFFAOYSA-N
XLogP4.29
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine 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

1-(4-butylphenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 106368810
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(4-methylsulfanylphenyl)ethanamine
CID 103913333
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-fluorophenyl)ethanamine
CID 113246407
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-methyl-1-phenylbutan-1-amine
CID 103912804
1-(2,4-dibromophenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 106368846
3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-2-methylbutan-2-ol
CID 106368581
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylpropan-2-amine
CID 65184221
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
CID 106369024
1-[4-(2-methylpropyl)phenyl]-N-(1H-pyrazol-4-ylmethyl)ethanamine
CID 54897141
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(4-trimethylsilylphenyl)methanamine
CID 106371023
5-[[1-[4-(2-methylpropyl)phenyl]ethylamino]methyl]furan-2-carbonitrile
CID 115651497
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(4-methylsulfanylphenyl)ethanamine
CID 113350582

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine (CID 103912622) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine is CCc1cnc(CNC(C)c2ccc(CC(C)C)cc2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine?
The InChIKey is YZINIHXIVAAGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-5-17-11-20-18(21-17)12-19-14(4)16-8-6-15(7-9-16)10-13(2)3/h6-9,11,13-14,19H,5,10,12H2,1-4H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine has a molecular weight of 286.42 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-[4-(2-methylpropyl)phenyl]ethanamine is sourced from PubChem (CID 103912622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).