[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol

C14H17NO2 — CID 103781809

IUPAC[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol
SMILESCC(NCc1cccc(CO)c1)c1ccco1
InChIInChI=1S/C14H17NO2/c1-11(14-6-3-7-17-14)15-9-12-4-2-5-13(8-12)10-16/h2-8,11,15-16H,9-10H2,1H3
InChIKeyVLNBGQASUXPBKR-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.62
Rot. Bonds5

About [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol

[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol (PubChem CID 103781809) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol.

Molecular Properties

Compound Name[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol
PubChem CID103781809
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol
SMILESCC(NCc1cccc(CO)c1)c1ccco1
InChIInChI=1S/C14H17NO2/c1-11(14-6-3-7-17-14)15-9-12-4-2-5-13(8-12)10-16/h2-8,11,15-16H,9-10H2,1H3
InChIKeyVLNBGQASUXPBKR-UHFFFAOYSA-N
XLogP2.62
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-yl)-N-[(3-methylphenyl)methyl]ethanamine
CID 43181990
(1S)-1-(furan-2-yl)-N-[(3-methoxyphenyl)methyl]ethanamine
CID 81402590
3-[[1-(furan-2-yl)ethylamino]methyl]benzonitrile
CID 43401833
[3-[[1-(5-methylfuran-2-yl)ethylamino]methyl]phenyl]methanol
CID 113261251
(1S)-N-[(3-ethoxyphenyl)methyl]-1-(furan-2-yl)ethanamine
CID 81402683
N-[(3,4-dibromophenyl)methyl]-1-(furan-2-yl)ethanamine
CID 115692983
(1S)-N-[(3,4-dichlorophenyl)methyl]-1-(furan-2-yl)ethanamine
CID 81403339
(1R)-1-(furan-2-yl)-N-[(3-propoxyphenyl)methyl]ethanamine
CID 81403687
(1S)-N-[(3-chloro-4-methylphenyl)methyl]-1-(furan-2-yl)ethanamine
CID 106816999
N-[(4-fluorophenyl)methyl]-1-(furan-2-yl)ethanamine
CID 43178684
[3-[[1-(4-ethylphenyl)ethylamino]methyl]phenyl]methanol
CID 103781733
[3-[[1-(4-bromophenyl)ethylamino]methyl]phenyl]methanol
CID 103729618

Frequently Asked Questions

What is the IUPAC name of [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol?
The IUPAC name of [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol (CID 103781809) is [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol.
What is the SMILES notation for [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol?
The canonical SMILES for [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol is CC(NCc1cccc(CO)c1)c1ccco1.
What is the InChIKey of [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol?
The InChIKey is VLNBGQASUXPBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-11(14-6-3-7-17-14)15-9-12-4-2-5-13(8-12)10-16/h2-8,11,15-16H,9-10H2,1H3.
What are the key properties of [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol?
[3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol has a molecular weight of 231.30 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[1-(furan-2-yl)ethylamino]methyl]phenyl]methanol is sourced from PubChem (CID 103781809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).