3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine

C15H31NO — CID 65168173

IUPAC3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine
SMILESCCOC1CC(NC(CC)C(C)C)C1(C)CC
InChIInChI=1S/C15H31NO/c1-7-12(11(4)5)16-13-10-14(17-9-3)15(13,6)8-2/h11-14,16H,7-10H2,1-6H3
InChIKeyJDZZNBKCQQRUPF-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.60
Rot. Bonds7

About 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine

3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine (PubChem CID 65168173) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine
PubChem CID65168173
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine
SMILESCCOC1CC(NC(CC)C(C)C)C1(C)CC
InChIInChI=1S/C15H31NO/c1-7-12(11(4)5)16-13-10-14(17-9-3)15(13,6)8-2/h11-14,16H,7-10H2,1-6H3
InChIKeyJDZZNBKCQQRUPF-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethoxy-2-ethyl-2-methyl-N-(3-methylbutan-2-yl)cyclobutan-1-amine
CID 65168094
3-ethoxy-N-(1-ethoxypropan-2-yl)-2-ethyl-2-methylcyclobutan-1-amine
CID 65169280
3-ethoxy-2-ethyl-N-hexan-3-yl-2-methylcyclobutan-1-amine
CID 65169181
3-ethoxy-2-ethyl-2-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 65170309
2-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]propane-1,3-diol
CID 65315597
ethyl 2-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]propanoate
CID 65167647
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)hydroxylamine
CID 82685490
3-ethoxy-2-ethyl-2-methyl-N-(1-phenylethyl)cyclobutan-1-amine
CID 65170112
2-N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-N,1-N,4-trimethylpentane-1,2-diamine
CID 65167586
3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-2-methylsulfanylbutan-1-ol
CID 106159068
3-ethoxy-2-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-methylcyclobutan-1-amine
CID 65167987
N-[(1S)-1-(3-bromophenyl)ethyl]-3-ethoxy-2-ethyl-2-methylcyclobutan-1-amine
CID 81382778

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine?
The IUPAC name of 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine (CID 65168173) is 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine?
The canonical SMILES for 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine is CCOC1CC(NC(CC)C(C)C)C1(C)CC.
What is the InChIKey of 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine?
The InChIKey is JDZZNBKCQQRUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-7-12(11(4)5)16-13-10-14(17-9-3)15(13,6)8-2/h11-14,16H,7-10H2,1-6H3.
What are the key properties of 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine?
3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.60, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-ethyl-2-methyl-N-(2-methylpentan-3-yl)cyclobutan-1-amine is sourced from PubChem (CID 65168173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).