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

C15H23NO — CID 103164095

IUPAC1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine
SMILESCCOC1CC(CC(N)Cc2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-2-17-15-10-13(11-15)9-14(16)8-12-6-4-3-5-7-12/h3-7,13-15H,2,8-11,16H2,1H3
InChIKeyVXGXANXSCSRVKE-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.76
Rot. Bonds6

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

1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine (PubChem CID 103164095) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine
PubChem CID103164095
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine
SMILESCCOC1CC(CC(N)Cc2ccccc2)C1
InChIInChI=1S/C15H23NO/c1-2-17-15-10-13(11-15)9-14(16)8-12-6-4-3-5-7-12/h3-7,13-15H,2,8-11,16H2,1H3
InChIKeyVXGXANXSCSRVKE-UHFFFAOYSA-N
XLogP2.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine?
The IUPAC name of 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine (CID 103164095) is 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine.
What is the SMILES notation for 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine?
The canonical SMILES for 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine is CCOC1CC(CC(N)Cc2ccccc2)C1.
What is the InChIKey of 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine?
The InChIKey is VXGXANXSCSRVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-17-15-10-13(11-15)9-14(16)8-12-6-4-3-5-7-12/h3-7,13-15H,2,8-11,16H2,1H3.
What are the key properties of 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine?
1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine has a molecular weight of 233.36 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine is sourced from PubChem (CID 103164095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).