[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol

C10H15NO2 — CID 79138177

IUPAC[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol
SMILESNCC1(C(O)c2ccoc2)CCC1
InChIInChI=1S/C10H15NO2/c11-7-10(3-1-4-10)9(12)8-2-5-13-6-8/h2,5-6,9,12H,1,3-4,7,11H2
InChIKeyNPSFYDMAMVTXAP-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.44
Rot. Bonds3

About [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol

[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol (PubChem CID 79138177) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol
PubChem CID79138177
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol
SMILESNCC1(C(O)c2ccoc2)CCC1
InChIInChI=1S/C10H15NO2/c11-7-10(3-1-4-10)9(12)8-2-5-13-6-8/h2,5-6,9,12H,1,3-4,7,11H2
InChIKeyNPSFYDMAMVTXAP-UHFFFAOYSA-N
XLogP1.44
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol?
The IUPAC name of [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol (CID 79138177) is [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol is NCC1(C(O)c2ccoc2)CCC1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol?
The InChIKey is NPSFYDMAMVTXAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c11-7-10(3-1-4-10)9(12)8-2-5-13-6-8/h2,5-6,9,12H,1,3-4,7,11H2.
What are the key properties of [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol?
[1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol has a molecular weight of 181.23 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]-(furan-3-yl)methanol is sourced from PubChem (CID 79138177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).