N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine

C20H26N2 — CID 118713781

IUPACN-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine
SMILESc1ccc2cc(CN(CC3CNC3)C3CCCC3)ccc2c1
InChIInChI=1S/C20H26N2/c1-2-6-19-11-16(9-10-18(19)5-1)14-22(15-17-12-21-13-17)20-7-3-4-8-20/h1-2,5-6,9-11,17,20-21H,3-4,7-8,12-15H2
InChIKeyMZSBLTQPEGPTAY-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.80
Rot. Bonds5

About N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine

N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine (PubChem CID 118713781) has the molecular formula C20H26N2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine
PubChem CID118713781
Molecular FormulaC20H26N2
Molecular Weight294.44 g/mol
Exact Mass294.21
IUPAC NameN-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine
SMILESc1ccc2cc(CN(CC3CNC3)C3CCCC3)ccc2c1
InChIInChI=1S/C20H26N2/c1-2-6-19-11-16(9-10-18(19)5-1)14-22(15-17-12-21-13-17)20-7-3-4-8-20/h1-2,5-6,9-11,17,20-21H,3-4,7-8,12-15H2
InChIKeyMZSBLTQPEGPTAY-UHFFFAOYSA-N
XLogP3.80
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine?
The IUPAC name of N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine (CID 118713781) is N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine is c1ccc2cc(CN(CC3CNC3)C3CCCC3)ccc2c1.
What is the InChIKey of N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine?
The InChIKey is MZSBLTQPEGPTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2/c1-2-6-19-11-16(9-10-18(19)5-1)14-22(15-17-12-21-13-17)20-7-3-4-8-20/h1-2,5-6,9-11,17,20-21H,3-4,7-8,12-15H2.
What are the key properties of N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine?
N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine has a molecular weight of 294.44 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine is sourced from PubChem (CID 118713781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).