[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine

C13H15NO2 — CID 60929324

IUPAC[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine
SMILESCc1cc(CN)ccc1OCc1ccco1
InChIInChI=1S/C13H15NO2/c1-10-7-11(8-14)4-5-13(10)16-9-12-3-2-6-15-12/h2-7H,8-9,14H2,1H3
InChIKeyIRHUUIZDUWGCHZ-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.63
Rot. Bonds4

About [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine

[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine (PubChem CID 60929324) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine.

Molecular Properties

Compound Name[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine
PubChem CID60929324
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine
SMILESCc1cc(CN)ccc1OCc1ccco1
InChIInChI=1S/C13H15NO2/c1-10-7-11(8-14)4-5-13(10)16-9-12-3-2-6-15-12/h2-7H,8-9,14H2,1H3
InChIKeyIRHUUIZDUWGCHZ-UHFFFAOYSA-N
XLogP2.63
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[(4-methoxyphenyl)methoxy]-3-methylphenyl]methanamine
CID 54934427
2-[(2-fluoro-3-methylphenoxy)methyl]furan
CID 107661924
2-[(2-methyl-5-propan-2-ylphenoxy)methyl]furan
CID 59709312
[5-(furan-2-ylmethoxymethyl)-2-methoxyphenyl]methanamine
CID 65338776
4-[4-amino-3-(furan-2-ylmethoxy)phenyl]-2-(furan-2-ylmethoxy)aniline
CID 22741608
[2-(furan-2-ylmethoxy)-6-propyl-4-pyridinyl]methanamine
CID 113381551
ethyl 3-amino-4-(furan-2-ylmethoxy)benzoate
CID 61312680
2-[4-(furan-2-ylmethoxy)phenyl]ethanamine
CID 65362318
[2-fluoro-6-(furan-2-ylmethoxy)phenyl]methanamine
CID 79516547
(1S)-1-[3-chloro-4-(furan-2-ylmethoxy)phenyl]ethanamine
CID 78937702
[5-[(2,4-dimethylphenoxy)methyl]furan-2-yl]methanamine
CID 62452413
[4-[(2-bromophenoxy)methyl]-3-methylphenyl]methanamine
CID 114479347

Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine?
The IUPAC name of [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine (CID 60929324) is [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine.
What is the SMILES notation for [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine?
The canonical SMILES for [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine is Cc1cc(CN)ccc1OCc1ccco1.
What is the InChIKey of [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine?
The InChIKey is IRHUUIZDUWGCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-10-7-11(8-14)4-5-13(10)16-9-12-3-2-6-15-12/h2-7H,8-9,14H2,1H3.
What are the key properties of [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine?
[4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine has a molecular weight of 217.27 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-ylmethoxy)-3-methylphenyl]methanamine is sourced from PubChem (CID 60929324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).