[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol

C11H16BrNO2 — CID 115927959

IUPAC[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol
SMILESCC(NC1(CO)CCC1)c1occc1Br
InChIInChI=1S/C11H16BrNO2/c1-8(10-9(12)3-6-15-10)13-11(7-14)4-2-5-11/h3,6,8,13-14H,2,4-5,7H2,1H3
InChIKeyPWPDMPLRHMJQMQ-UHFFFAOYSA-N
MW274.16 g/mol
LogP2.61
Rot. Bonds4

About [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol

[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol (PubChem CID 115927959) has the molecular formula C11H16BrNO2 and a molecular weight of 274.16 g/mol. Its IUPAC name is [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol
PubChem CID115927959
Molecular FormulaC11H16BrNO2
Molecular Weight274.16 g/mol
Exact Mass273.04
IUPAC Name[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol
SMILESCC(NC1(CO)CCC1)c1occc1Br
InChIInChI=1S/C11H16BrNO2/c1-8(10-9(12)3-6-15-10)13-11(7-14)4-2-5-11/h3,6,8,13-14H,2,4-5,7H2,1H3
InChIKeyPWPDMPLRHMJQMQ-UHFFFAOYSA-N
XLogP2.61
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.16
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-bromofuran-2-yl)-N-[(2-methyloxolan-2-yl)methyl]ethanamine
CID 115727604
(3-bromofuran-2-yl)-(1-methylsulfanylcyclobutyl)methanol
CID 130506442
N-[1-(3-bromofuran-2-yl)ethyl]-2-methylpropan-1-amine
CID 115704758
1-(3-bromofuran-2-yl)-N-(cyclopentylmethyl)ethanamine
CID 115712391
N-[1-(3-bromofuran-2-yl)ethyl]cycloheptanamine
CID 115705100
[1-[1-(4-bromo-2-fluorophenyl)ethylamino]cyclopropyl]methanol
CID 91660867
[1-[1-(4-bromo-3-methylphenyl)ethylamino]cyclopropyl]methanol
CID 115976164
2-[1-(3-bromofuran-2-yl)ethylamino]-2-methylbutan-1-ol
CID 115927326
1-[(3-bromofuran-2-yl)-hydroxymethyl]cyclohexan-1-ol
CID 103451748
1-[(3-bromofuran-2-yl)-hydroxymethyl]cycloheptan-1-ol
CID 103452084
[1-[1-(4-bromo-3-fluorophenyl)ethylamino]cyclopropyl]methanol
CID 115929622
1-[amino-(3-bromofuran-2-yl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066055

Frequently Asked Questions

What is the IUPAC name of [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol?
The IUPAC name of [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol (CID 115927959) is [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol.
What is the SMILES notation for [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol?
The canonical SMILES for [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol is CC(NC1(CO)CCC1)c1occc1Br.
What is the InChIKey of [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol?
The InChIKey is PWPDMPLRHMJQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrNO2/c1-8(10-9(12)3-6-15-10)13-11(7-14)4-2-5-11/h3,6,8,13-14H,2,4-5,7H2,1H3.
What are the key properties of [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol?
[1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol has a molecular weight of 274.16 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(3-bromofuran-2-yl)ethylamino]cyclobutyl]methanol is sourced from PubChem (CID 115927959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).