N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

C17H21NO — CID 43480600

IUPACN-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccc2c(c1)CCCC2)c1ccc(C)o1
InChIInChI=1S/C17H21NO/c1-12-7-10-16(19-12)17(18-2)15-9-8-13-5-3-4-6-14(13)11-15/h7-11,17-18H,3-6H2,1-2H3
InChIKeyLKGWEIFIQFDVEB-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.78
Rot. Bonds3

About N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 43480600) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
PubChem CID43480600
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC NameN-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccc2c(c1)CCCC2)c1ccc(C)o1
InChIInChI=1S/C17H21NO/c1-12-7-10-16(19-12)17(18-2)15-9-8-13-5-3-4-6-14(13)11-15/h7-11,17-18H,3-6H2,1-2H3
InChIKeyLKGWEIFIQFDVEB-UHFFFAOYSA-N
XLogP3.78
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346567
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
1-(3-bromophenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43480640
1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43480670
1-(3,5-dibromophenyl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 107979764
N-methyl-1-(5-methylfuran-2-yl)-1-phenylmethanamine
CID 43481483
N-methyl-1-(5-methylfuran-2-yl)-1-[4-(2-methylpropyl)phenyl]methanamine
CID 43480502
1-(3-fluoro-4-methoxyphenyl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
CID 43487598
1-(4-chloro-3-methoxyphenyl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
CID 105006756
1-(4-chloro-3-fluorophenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 107998576
1-(2-bromo-4-chlorophenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 107987343
1-(2,3-dihydro-1H-inden-5-yl)-1-(3-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 43487646

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (CID 43480600) is N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is CNC(c1ccc2c(c1)CCCC2)c1ccc(C)o1.
What is the InChIKey of N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is LKGWEIFIQFDVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-12-7-10-16(19-12)17(18-2)15-9-8-13-5-3-4-6-14(13)11-15/h7-11,17-18H,3-6H2,1-2H3.
What are the key properties of N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
N-methyl-1-(5-methylfuran-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 255.36 g/mol, XLogP of 3.78, 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-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 43480600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).