N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine

C15H26N2O2 — CID 79237350

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCc2c(C)noc2C)C1(C)CC
InChIInChI=1S/C15H26N2O2/c1-6-15(5)13(8-14(15)18-7-2)16-9-12-10(3)17-19-11(12)4/h13-14,16H,6-9H2,1-5H3
InChIKeyOWHBNWMYIRPYLH-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.97
Rot. Bonds6

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine (PubChem CID 79237350) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
PubChem CID79237350
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCc2c(C)noc2C)C1(C)CC
InChIInChI=1S/C15H26N2O2/c1-6-15(5)13(8-14(15)18-7-2)16-9-12-10(3)17-19-11(12)4/h13-14,16H,6-9H2,1-5H3
InChIKeyOWHBNWMYIRPYLH-UHFFFAOYSA-N
XLogP2.97
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

3-ethoxy-2-ethyl-2-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclobutan-1-amine
CID 65167740
3-ethoxy-2-ethyl-2-methyl-N-(1,3-thiazol-4-ylmethyl)cyclobutan-1-amine
CID 65169503
3-ethoxy-N-(2-ethoxyethyl)-2-ethyl-2-methylcyclobutan-1-amine
CID 65167908
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)hydroxylamine
CID 82685490
1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(3-ethoxy-2,2-diethylcyclobutyl)-2-methylguanidine
CID 109390590
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-ethoxyspiro[3.4]octan-1-amine
CID 79231073
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3,4-dimethylcyclohexan-1-amine
CID 64738720
cis-(1S,3R)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylcyclopentan-1-amine
CID 97039099
3-ethoxy-2-ethyl-2-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclobutan-1-amine
CID 106289842
1-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]pentan-3-ol
CID 113497546
N-(2-butoxyethyl)-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
CID 65168217
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 78953381

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine (CID 79237350) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine is CCOC1CC(NCc2c(C)noc2C)C1(C)CC.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine?
The InChIKey is OWHBNWMYIRPYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-6-15(5)13(8-14(15)18-7-2)16-9-12-10(3)17-19-11(12)4/h13-14,16H,6-9H2,1-5H3.
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine has a molecular weight of 266.38 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine is sourced from PubChem (CID 79237350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).