1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine

C10H21NO2 — CID 103169094

IUPAC1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine
SMILESCCOC1CC(CC(N)COC)C1
InChIInChI=1S/C10H21NO2/c1-3-13-10-5-8(6-10)4-9(11)7-12-2/h8-10H,3-7,11H2,1-2H3
InChIKeySYNIBLNVUKYLDG-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.17
Rot. Bonds6

About 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine

1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine (PubChem CID 103169094) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine.

Molecular Properties

Compound Name1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine
PubChem CID103169094
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine
SMILESCCOC1CC(CC(N)COC)C1
InChIInChI=1S/C10H21NO2/c1-3-13-10-5-8(6-10)4-9(11)7-12-2/h8-10H,3-7,11H2,1-2H3
InChIKeySYNIBLNVUKYLDG-UHFFFAOYSA-N
XLogP1.17
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine?
The IUPAC name of 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine (CID 103169094) is 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine.
What is the SMILES notation for 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine?
The canonical SMILES for 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine is CCOC1CC(CC(N)COC)C1.
What is the InChIKey of 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine?
The InChIKey is SYNIBLNVUKYLDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-13-10-5-8(6-10)4-9(11)7-12-2/h8-10H,3-7,11H2,1-2H3.
What are the key properties of 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine?
1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine has a molecular weight of 187.28 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxycyclobutyl)-3-methoxypropan-2-amine is sourced from PubChem (CID 103169094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).