1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine

C18H21NO — CID 102649497

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
SMILESCNC(Cc1cccc2ccccc12)C1=CCCCO1
InChIInChI=1S/C18H21NO/c1-19-17(18-11-4-5-12-20-18)13-15-9-6-8-14-7-2-3-10-16(14)15/h2-3,6-11,17,19H,4-5,12-13H2,1H3
InChIKeyFJWZGRUDFOAHCH-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.66
Rot. Bonds4

About 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine

1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine (PubChem CID 102649497) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
PubChem CID102649497
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
SMILESCNC(Cc1cccc2ccccc12)C1=CCCCO1
InChIInChI=1S/C18H21NO/c1-19-17(18-11-4-5-12-20-18)13-15-9-6-8-14-7-2-3-10-16(14)15/h2-3,6-11,17,19H,4-5,12-13H2,1H3
InChIKeyFJWZGRUDFOAHCH-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-(2-fluorophenyl)-N-methylethanamine
CID 102651363
2-(2-bromophenyl)-1-(2,3-dihydrofuran-5-yl)-N-methylethanamine
CID 102651472
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
CID 102647204
1-(2,3-dihydrofuran-5-yl)-N-methyl-2-naphthalen-2-ylethanamine
CID 102652890
2-(2-chlorophenyl)sulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylethanamine
CID 102647655
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
N-methyl-2-naphthalen-1-yl-1-pyrimidin-5-ylethanamine
CID 105118515
1-(1,4-dioxan-2-yl)-N-methyl-2-naphthalen-1-ylethanamine
CID 65352577
2-(4-chlorophenoxy)-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylethanamine
CID 102648745
N-methyl-1-(1-methylpyrazol-3-yl)-2-naphthalen-1-ylethanamine
CID 65200268
(2-naphthalen-1-yl-1-phenylethyl)hydrazine
CID 105199335
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-3-methylbutan-1-amine
CID 102647187

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine (CID 102649497) is 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine is CNC(Cc1cccc2ccccc12)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine?
The InChIKey is FJWZGRUDFOAHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-19-17(18-11-4-5-12-20-18)13-15-9-6-8-14-7-2-3-10-16(14)15/h2-3,6-11,17,19H,4-5,12-13H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine?
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine has a molecular weight of 267.37 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 102649497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).