2-(aminomethyl)-3-(furan-3-yl)propan-1-ol

C8H13NO2 — CID 63204142

IUPAC2-(aminomethyl)-3-(furan-3-yl)propan-1-ol
SMILESNCC(CO)Cc1ccoc1
InChIInChI=1S/C8H13NO2/c9-4-8(5-10)3-7-1-2-11-6-7/h1-2,6,8,10H,3-5,9H2
InChIKeyHDRLIKIYQVFLOU-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.39
Rot. Bonds4

About 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol

2-(aminomethyl)-3-(furan-3-yl)propan-1-ol (PubChem CID 63204142) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-3-(furan-3-yl)propan-1-ol
PubChem CID63204142
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-(aminomethyl)-3-(furan-3-yl)propan-1-ol
SMILESNCC(CO)Cc1ccoc1
InChIInChI=1S/C8H13NO2/c9-4-8(5-10)3-7-1-2-11-6-7/h1-2,6,8,10H,3-5,9H2
InChIKeyHDRLIKIYQVFLOU-UHFFFAOYSA-N
XLogP0.39
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol?
The IUPAC name of 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol (CID 63204142) is 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol?
The canonical SMILES for 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol is NCC(CO)Cc1ccoc1.
What is the InChIKey of 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol?
The InChIKey is HDRLIKIYQVFLOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c9-4-8(5-10)3-7-1-2-11-6-7/h1-2,6,8,10H,3-5,9H2.
What are the key properties of 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol?
2-(aminomethyl)-3-(furan-3-yl)propan-1-ol has a molecular weight of 155.20 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-3-(furan-3-yl)propan-1-ol is sourced from PubChem (CID 63204142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).