N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine

C14H17NO2 — CID 106486033

IUPACN-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
SMILESCNCc1cccc(OCc2ccc(C)o2)c1
InChIInChI=1S/C14H17NO2/c1-11-6-7-14(17-11)10-16-13-5-3-4-12(8-13)9-15-2/h3-8,15H,9-10H2,1-2H3
InChIKeyNJPRFDJSFALASQ-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.89
Rot. Bonds5

About N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine

N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine (PubChem CID 106486033) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
PubChem CID106486033
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC NameN-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
SMILESCNCc1cccc(OCc2ccc(C)o2)c1
InChIInChI=1S/C14H17NO2/c1-11-6-7-14(17-11)10-16-13-5-3-4-12(8-13)9-15-2/h3-8,15H,9-10H2,1-2H3
InChIKeyNJPRFDJSFALASQ-UHFFFAOYSA-N
XLogP2.89
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[(5-bromofuran-2-yl)methoxy]phenyl]-N-methylmethanamine
CID 106485972
[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanol
CID 79868965
1-[3-(furan-2-ylmethoxy)phenyl]-N-methylmethanamine;hydrochloride
CID 67855263
1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62452138
1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
CID 63986399
N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
CID 19744687
1-(3-ethoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]methanamine
CID 60776548
1-[5-[(3-ethylphenoxy)methyl]-3-methylfuran-2-yl]-N-methylmethanamine
CID 62451776
N-methyl-1-[3-[(3-methylphenoxy)methyl]phenyl]methanamine
CID 55077028
1-[3-(furan-3-ylmethoxy)phenyl]-N-methylmethanamine
CID 106486019
1-[5-[(3-bromophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62459188
N-methyl-1-[3-[(6-methyl-2-pyridinyl)methoxy]phenyl]methanamine
CID 79268111

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine?
The IUPAC name of N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine (CID 106486033) is N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine.
What is the SMILES notation for N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine?
The canonical SMILES for N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine is CNCc1cccc(OCc2ccc(C)o2)c1.
What is the InChIKey of N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine?
The InChIKey is NJPRFDJSFALASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-11-6-7-14(17-11)10-16-13-5-3-4-12(8-13)9-15-2/h3-8,15H,9-10H2,1-2H3.
What are the key properties of N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine?
N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine has a molecular weight of 231.30 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine is sourced from PubChem (CID 106486033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).