N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine

C14H17NO — CID 115789821

IUPACN-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)c1coc(C)c1
InChIInChI=1S/C14H17NO/c1-10-5-4-6-12(7-10)14(15-3)13-8-11(2)16-9-13/h4-9,14-15H,1-3H3
InChIKeyWIFPLLPXBDTFGA-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.21
Rot. Bonds3

About N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine

N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine (PubChem CID 115789821) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine
PubChem CID115789821
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine
SMILESCNC(c1cccc(C)c1)c1coc(C)c1
InChIInChI=1S/C14H17NO/c1-10-5-4-6-12(7-10)14(15-3)13-8-11(2)16-9-13/h4-9,14-15H,1-3H3
InChIKeyWIFPLLPXBDTFGA-UHFFFAOYSA-N
XLogP3.21
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(5-methylfuran-3-yl)-1-phenylmethanamine
CID 114819899
1-(3-fluorophenyl)-N-methyl-1-(5-methylfuran-3-yl)methanamine
CID 115791802
N-[(5-methylfuran-3-yl)-(3-methylphenyl)methyl]ethanamine
CID 115790238
N-methyl-1-(5-methylfuran-3-yl)-1-[3-(trifluoromethyl)phenyl]methanamine
CID 115850612
1-(3,4-dimethylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 43480217
1-(3-bromo-4-methylphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115790289
1-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 43481682
1-(2,6-difluorophenyl)-N-methyl-1-(5-methylfuran-3-yl)methanamine
CID 115859709
1-(4-iodophenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 115790034
N-methyl-1-(3-methylphenyl)-1-(2,3,4,5,6-pentamethylphenyl)methanamine
CID 43482466
N-methyl-1-(3-methylphenyl)-1-pyrimidin-5-ylmethanamine
CID 62491535
1-(3-bromo-4-fluorophenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 79747347

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine?
The IUPAC name of N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine (CID 115789821) is N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine?
The canonical SMILES for N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine is CNC(c1cccc(C)c1)c1coc(C)c1.
What is the InChIKey of N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine?
The InChIKey is WIFPLLPXBDTFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-10-5-4-6-12(7-10)14(15-3)13-8-11(2)16-9-13/h4-9,14-15H,1-3H3.
What are the key properties of N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine?
N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine has a molecular weight of 215.30 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylfuran-3-yl)-1-(3-methylphenyl)methanamine is sourced from PubChem (CID 115789821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).