1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine

C16H23N — CID 63772469

IUPAC1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
SMILESNC1(CC2CCCc3ccccc32)CCCC1
InChIInChI=1S/C16H23N/c17-16(10-3-4-11-16)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,6,9,14H,3-5,7-8,10-12,17H2
InChIKeyFCMNEDYPYAGSQX-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.77
Rot. Bonds2

About 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine

1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine (PubChem CID 63772469) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
PubChem CID63772469
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
SMILESNC1(CC2CCCc3ccccc32)CCCC1
InChIInChI=1S/C16H23N/c17-16(10-3-4-11-16)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,6,9,14H,3-5,7-8,10-12,17H2
InChIKeyFCMNEDYPYAGSQX-UHFFFAOYSA-N
XLogP3.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine (CID 63772469) is 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine is NC1(CC2CCCc3ccccc32)CCCC1.
What is the InChIKey of 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine?
The InChIKey is FCMNEDYPYAGSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c17-16(10-3-4-11-16)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,6,9,14H,3-5,7-8,10-12,17H2.
What are the key properties of 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine?
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine has a molecular weight of 229.37 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 63772469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).