N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine

C15H26N2O — CID 66478580

IUPACN-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCCNCCCc1ncc(C2C(C)(C)C2(C)C)o1
InChIInChI=1S/C15H26N2O/c1-6-16-9-7-8-12-17-10-11(18-12)13-14(2,3)15(13,4)5/h10,13,16H,6-9H2,1-5H3
InChIKeyIZFQGJHMNMAUPG-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.37
Rot. Bonds6

About N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine

N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine (PubChem CID 66478580) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine
PubChem CID66478580
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCCNCCCc1ncc(C2C(C)(C)C2(C)C)o1
InChIInChI=1S/C15H26N2O/c1-6-16-9-7-8-12-17-10-11(18-12)13-14(2,3)15(13,4)5/h10,13,16H,6-9H2,1-5H3
InChIKeyIZFQGJHMNMAUPG-UHFFFAOYSA-N
XLogP3.37
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]ethanamine
CID 66478578
3-[5-(1,4-dioxan-2-yl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 65186864
2-methoxy-N-[[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]methyl]ethanamine
CID 66478464
N-ethyl-3-[5-(methylsulfonylmethyl)-1,3-oxazol-2-yl]propan-1-amine
CID 65187355
N-[3-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
CID 107185194
3-[5-(3-bromo-4-methylphenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 81488018
3-[5-(3-chloro-4-methylphenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 65187301
N-ethyl-2-[5-(5-methyloxolan-2-yl)-1,3-oxazol-2-yl]ethanamine
CID 81327813
3-[5-(oxan-2-yl)-1,3-oxazol-2-yl]-N-propylpropan-1-amine
CID 65187076
3-(5-cyclobutyl-1,3-oxazol-2-yl)-N-(2-methoxyethyl)propan-1-amine
CID 65184648
N-ethyl-3-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]propan-1-amine
CID 65187113
3-[5-(2,2-dimethylcyclopropyl)-1,3,4-oxadiazol-2-yl]-N-ethylpropan-1-amine
CID 107003036

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine?
The IUPAC name of N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine (CID 66478580) is N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine.
What is the SMILES notation for N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine?
The canonical SMILES for N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine is CCNCCCc1ncc(C2C(C)(C)C2(C)C)o1.
What is the InChIKey of N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine?
The InChIKey is IZFQGJHMNMAUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-6-16-9-7-8-12-17-10-11(18-12)13-14(2,3)15(13,4)5/h10,13,16H,6-9H2,1-5H3.
What are the key properties of N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine?
N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-2-yl]propan-1-amine is sourced from PubChem (CID 66478580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).