3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine

C15H23NO3 — CID 107943638

IUPAC3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine
SMILESCCCOC1C(N)CC1Oc1cccc(OCC)c1
InChIInChI=1S/C15H23NO3/c1-3-8-18-15-13(16)10-14(15)19-12-7-5-6-11(9-12)17-4-2/h5-7,9,13-15H,3-4,8,10,16H2,1-2H3
InChIKeyDQFWVHSDHQGXGB-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.36
Rot. Bonds7

About 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine

3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine (PubChem CID 107943638) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine.

Molecular Properties

Compound Name3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine
PubChem CID107943638
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine
SMILESCCCOC1C(N)CC1Oc1cccc(OCC)c1
InChIInChI=1S/C15H23NO3/c1-3-8-18-15-13(16)10-14(15)19-12-7-5-6-11(9-12)17-4-2/h5-7,9,13-15H,3-4,8,10,16H2,1-2H3
InChIKeyDQFWVHSDHQGXGB-UHFFFAOYSA-N
XLogP2.36
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-3-(3-ethoxyphenoxy)cyclobutan-1-amine
CID 113440032
1-(3-chloro-2-propoxycyclobutyl)oxy-3-ethoxybenzene
CID 107942973
2-propoxy-3-(4-propoxyphenoxy)cyclobutan-1-amine
CID 107943448
3-naphthalen-2-yloxy-2-propoxycyclobutan-1-amine
CID 107943277
3-(3,4-dimethylphenoxy)-2-propoxycyclobutan-1-amine
CID 107943230
2-(3-ethoxyphenoxy)-4-propylcyclohexan-1-amine
CID 62336151
2-ethoxy-3-(3-propan-2-ylphenoxy)cyclobutan-1-amine
CID 104675953
3-(3-chloro-4-fluorophenoxy)-2-propoxycyclobutan-1-amine
CID 107943680
3-(3-bromophenoxy)-2-(2-methoxyethoxy)cyclobutan-1-amine
CID 114032265
1-chloro-3-(3-chloro-2-propoxycyclobutyl)oxybenzene
CID 107942730
2-propoxy-3-[4-(trifluoromethoxy)phenoxy]cyclobutan-1-amine
CID 107943861
3-(3-chlorophenoxy)-2-methoxycyclobutan-1-amine
CID 104674327

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine?
The IUPAC name of 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine (CID 107943638) is 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine.
What is the SMILES notation for 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine?
The canonical SMILES for 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine is CCCOC1C(N)CC1Oc1cccc(OCC)c1.
What is the InChIKey of 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine?
The InChIKey is DQFWVHSDHQGXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-3-8-18-15-13(16)10-14(15)19-12-7-5-6-11(9-12)17-4-2/h5-7,9,13-15H,3-4,8,10,16H2,1-2H3.
What are the key properties of 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine?
3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine has a molecular weight of 265.35 g/mol, XLogP of 2.36, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethoxyphenoxy)-2-propoxycyclobutan-1-amine is sourced from PubChem (CID 107943638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).