(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride

C16H20ClN — CID 171208948

IUPAC(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride
SMILESCc1ccc([C@H](N)CC2CC2)c2ccccc12.Cl
InChIInChI=1S/C16H19N.ClH/c1-11-6-9-15(16(17)10-12-7-8-12)14-5-3-2-4-13(11)14;/h2-6,9,12,16H,7-8,10,17H2,1H3;1H/t16-;/m1./s1
InChIKeyBOSPSZIVWLLWPX-PKLMIRHRSA-N
MW261.80 g/mol
LogP4.37
Rot. Bonds3

About (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride

(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride (PubChem CID 171208948) has the molecular formula C16H20ClN and a molecular weight of 261.80 g/mol. Its IUPAC name is (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride
PubChem CID171208948
Molecular FormulaC16H20ClN
Molecular Weight261.80 g/mol
Exact Mass261.13
IUPAC Name(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride
SMILESCc1ccc([C@H](N)CC2CC2)c2ccccc12.Cl
InChIInChI=1S/C16H19N.ClH/c1-11-6-9-15(16(17)10-12-7-8-12)14-5-3-2-4-13(11)14;/h2-6,9,12,16H,7-8,10,17H2,1H3;1H/t16-;/m1./s1
InChIKeyBOSPSZIVWLLWPX-PKLMIRHRSA-N
XLogP4.37
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.80
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride?
The IUPAC name of (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride (CID 171208948) is (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride.
What is the SMILES notation for (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride?
The canonical SMILES for (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride is Cc1ccc([C@H](N)CC2CC2)c2ccccc12.Cl.
What is the InChIKey of (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride?
The InChIKey is BOSPSZIVWLLWPX-PKLMIRHRSA-N. The full InChI is InChI=1S/C16H19N.ClH/c1-11-6-9-15(16(17)10-12-7-8-12)14-5-3-2-4-13(11)14;/h2-6,9,12,16H,7-8,10,17H2,1H3;1H/t16-;/m1./s1.
What are the key properties of (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride?
(1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride has a molecular weight of 261.80 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-cyclopropyl-1-(4-methylnaphthalen-1-yl)ethanamine;hydrochloride is sourced from PubChem (CID 171208948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).