(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine

C13H15NO — CID 90212494

IUPAC(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine
SMILESCN[C@H](c1ccc(C)cc1)c1ccco1
InChIInChI=1S/C13H15NO/c1-10-5-7-11(8-6-10)13(14-2)12-4-3-9-15-12/h3-9,13-14H,1-2H3/t13-/m1/s1
InChIKeyPZPDSCXKQHPZKG-CYBMUJFWSA-N
MW201.27 g/mol
LogP2.90
Rot. Bonds3

About (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine

(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine (PubChem CID 90212494) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine
PubChem CID90212494
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine
SMILESCN[C@H](c1ccc(C)cc1)c1ccco1
InChIInChI=1S/C13H15NO/c1-10-5-7-11(8-6-10)13(14-2)12-4-3-9-15-12/h3-9,13-14H,1-2H3/t13-/m1/s1
InChIKeyPZPDSCXKQHPZKG-CYBMUJFWSA-N
XLogP2.90
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4-methylphenyl)-1-(furan-2-yl)-N-methylmethanamine
CID 106857596
1-(furan-2-yl)-N-methyl-1-(1H-pyrazol-4-yl)methanamine
CID 82237956
(1R)-N-[1-(furan-2-yl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81350046
1-(furan-2-yl)-1-(2-methoxy-4-methylphenyl)-N-methylmethanamine
CID 106792126
1-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 43626241
1-dibenzofuran-2-yl-1-(furan-2-yl)-N-methylmethanamine
CID 43482139
1-(furan-2-yl)-N-methyl-1-(3-methyl-2-pyridinyl)methanamine
CID 63949984
7-[furan-2-yl(methylamino)methyl]-1,5-dihydro-1,5-benzodiazepine-2,4-dione
CID 43483117
N-[furan-2-yl(phenyl)methyl]-2,4-dimethylaniline
CID 43103663
4-[(R)-methylamino-(4-methylphenyl)methyl]aniline
CID 90212370
1-(2,6-dimethyl-3-pyridinyl)-1-(furan-2-yl)-N-methylmethanamine
CID 82237737
1-(3,3-dimethyl-2H-1-benzofuran-5-yl)-1-(furan-2-yl)-N-methylmethanamine
CID 107293623

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine (CID 90212494) is (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine is CN[C@H](c1ccc(C)cc1)c1ccco1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine?
The InChIKey is PZPDSCXKQHPZKG-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H15NO/c1-10-5-7-11(8-6-10)13(14-2)12-4-3-9-15-12/h3-9,13-14H,1-2H3/t13-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine?
(1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine has a molecular weight of 201.27 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-methyl-1-(4-methylphenyl)methanamine is sourced from PubChem (CID 90212494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).