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

C14H21N — CID 115420847

IUPAC1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCCC(N)C1CCC(C)c2ccccc21
InChIInChI=1S/C14H21N/c1-3-14(15)13-9-8-10(2)11-6-4-5-7-12(11)13/h4-7,10,13-14H,3,8-9,15H2,1-2H3
InChIKeyPFRABIBHCDRSDF-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.40
Rot. Bonds2

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

1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (PubChem CID 115420847) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound Name1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
PubChem CID115420847
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
SMILESCCC(N)C1CCC(C)c2ccccc21
InChIInChI=1S/C14H21N/c1-3-14(15)13-9-8-10(2)11-6-4-5-7-12(11)13/h4-7,10,13-14H,3,8-9,15H2,1-2H3
InChIKeyPFRABIBHCDRSDF-UHFFFAOYSA-N
XLogP3.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The IUPAC name of 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine (CID 115420847) is 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The canonical SMILES for 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is CCC(N)C1CCC(C)c2ccccc21.
What is the InChIKey of 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
The InChIKey is PFRABIBHCDRSDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-14(15)13-9-8-10(2)11-6-4-5-7-12(11)13/h4-7,10,13-14H,3,8-9,15H2,1-2H3.
What are the key properties of 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine?
1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 115420847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).