N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine

C20H25N — CID 63251085

IUPACN-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCNC(CCc1ccccc1)C1CCCc2ccccc21
InChIInChI=1S/C20H25N/c1-21-20(15-14-16-8-3-2-4-9-16)19-13-7-11-17-10-5-6-12-18(17)19/h2-6,8-10,12,19-21H,7,11,13-15H2,1H3
InChIKeyWKWHYYGRAVEEDE-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.33
Rot. Bonds5

About N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine

N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (PubChem CID 63251085) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
PubChem CID63251085
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC NameN-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCNC(CCc1ccccc1)C1CCCc2ccccc21
InChIInChI=1S/C20H25N/c1-21-20(15-14-16-8-3-2-4-9-16)19-13-7-11-17-10-5-6-12-18(17)19/h2-6,8-10,12,19-21H,7,11,13-15H2,1H3
InChIKeyWKWHYYGRAVEEDE-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-3-phenylpropan-1-amine
CID 79748593
[3-(1-methylpyrazol-4-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propyl]hydrazine
CID 103025799
2-phenylethylbenzene;1-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene;toluene
CID 173264827
2-(5-bromo-2-pyridinyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 104802066
2-cyclopentyl-N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 63418635
2-(4-bromophenyl)-1-(2,3-dihydro-1H-inden-1-yl)-N-methylethanamine
CID 65404361
N-methyl-1-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 62718728
[2-(2-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]hydrazine
CID 105218856
N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-amine
CID 55188345
1-(2-fluorophenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 63250536
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-N-methyl-3-phenylpropan-1-amine
CID 79974764

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The IUPAC name of N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (CID 63251085) is N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The canonical SMILES for N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is CNC(CCc1ccccc1)C1CCCc2ccccc21.
What is the InChIKey of N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The InChIKey is WKWHYYGRAVEEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-21-20(15-14-16-8-3-2-4-9-16)19-13-7-11-17-10-5-6-12-18(17)19/h2-6,8-10,12,19-21H,7,11,13-15H2,1H3.
What are the key properties of N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine has a molecular weight of 279.43 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-phenyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 63251085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).