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

C12H20N2O — CID 106369024

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
SMILESCCc1cnc(CNC(C)C2(C)CC2)o1
InChIInChI=1S/C12H20N2O/c1-4-10-7-14-11(15-10)8-13-9(2)12(3)5-6-12/h7,9,13H,4-6,8H2,1-3H3
InChIKeyYQYPFUZMNGZFBA-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.52
Rot. Bonds5

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

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine (PubChem CID 106369024) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
PubChem CID106369024
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
SMILESCCc1cnc(CNC(C)C2(C)CC2)o1
InChIInChI=1S/C12H20N2O/c1-4-10-7-14-11(15-10)8-13-9(2)12(3)5-6-12/h7,9,13H,4-6,8H2,1-3H3
InChIKeyYQYPFUZMNGZFBA-UHFFFAOYSA-N
XLogP2.52
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-{[5-(propan-2-yl)-1,3-oxazol-2-yl]methyl}-N-(pyrrolidin-3-yl)acetamide
CID 71873201
1-(5-Methyl-1,3-oxazol-2-yl)ethan-1-amine
CID 24255020
[5-(Propan-2-yl)-1,3-oxazol-2-yl]methanamine
CID 54594018
(5-Cyclopropyl-1,3-oxazol-2-yl)methanamine
CID 64989250
(5-Ethyl-1,3-oxazol-2-yl)methanamine
CID 65180193
5-Tert-butyl-2-[(2-ethylpiperidin-1-yl)methyl]-1,3-oxazole
CID 56684365
N-[[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]methyl]-N-ethylethanamine
CID 71895082
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-(pyrrolidin-3-yl)acetamide hydrochloride
CID 71756632
((5-Cyclopropyl-1,3-oxazol-2-yl)methyl)(methyl)amine dihydrochloride
CID 146050201
5-Tert-butyl-2-methyl-1,3-oxazole
CID 12639617
2,5-Ditert-butyl-1,3-oxazole
CID 12639618
5-Tert-butyl-2-propan-2-yl-1,3-oxazole
CID 23571128

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine (CID 106369024) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine is CCc1cnc(CNC(C)C2(C)CC2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine?
The InChIKey is YQYPFUZMNGZFBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-10-7-14-11(15-10)8-13-9(2)12(3)5-6-12/h7,9,13H,4-6,8H2,1-3H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine has a molecular weight of 208.30 g/mol, XLogP of 2.52, 5 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-(1-methylcyclopropyl)ethanamine is sourced from PubChem (CID 106369024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).