(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride

C14H16ClN — CID 171197351

IUPAC(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride
SMILESCc1ccc([C@H]2CCN2)c2ccccc12.Cl
InChIInChI=1S/C14H15N.ClH/c1-10-6-7-13(14-8-9-15-14)12-5-3-2-4-11(10)12;/h2-7,14-15H,8-9H2,1H3;1H/t14-;/m1./s1
InChIKeyITLDVVGJKRWIMW-PFEQFJNWSA-N
MW233.74 g/mol
LogP3.60
Rot. Bonds1

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

(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride (PubChem CID 171197351) has the molecular formula C14H16ClN and a molecular weight of 233.74 g/mol. Its IUPAC name is (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride.

Molecular Properties

Compound Name(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride
PubChem CID171197351
Molecular FormulaC14H16ClN
Molecular Weight233.74 g/mol
Exact Mass233.10
IUPAC Name(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride
SMILESCc1ccc([C@H]2CCN2)c2ccccc12.Cl
InChIInChI=1S/C14H15N.ClH/c1-10-6-7-13(14-8-9-15-14)12-5-3-2-4-11(10)12;/h2-7,14-15H,8-9H2,1H3;1H/t14-;/m1./s1
InChIKeyITLDVVGJKRWIMW-PFEQFJNWSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(2S)-azetidin-2-yl]naphthalen-1-ol
CID 55277860
3-(4-methylnaphthalen-1-yl)pyrrolidine
CID 70971659
(2R)-2-(2,3-dimethylphenyl)azetidine
CID 130714481
(2S)-2-(2-fluoro-3-methylphenyl)azetidine
CID 131182197
(2R)-2-(2,3-dimethoxyphenyl)azetidine;hydrochloride
CID 171197120
(2R)-2-(4-methoxynaphthalen-1-yl)pyrrolidine;hydrochloride
CID 171196102
2-(4-methylnaphthalen-1-yl)thiirane
CID 171782879
(2R)-2-pyren-1-ylazetidine;hydrochloride
CID 171197548
3-(4-methylnaphthalen-1-yl)-6-azabicyclo[3.1.1]heptane
CID 130377875
(2R)-2-naphthalen-1-ylpyrrolidine;hydrochloride
CID 154803630
(2R)-2-(3-bromo-2-methoxyphenyl)azetidine
CID 126961267
(2R)-2-(4-chloro-2-methylphenyl)azetidine
CID 130665012

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride?
The IUPAC name of (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride (CID 171197351) is (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride.
What is the SMILES notation for (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride?
The canonical SMILES for (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride is Cc1ccc([C@H]2CCN2)c2ccccc12.Cl.
What is the InChIKey of (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride?
The InChIKey is ITLDVVGJKRWIMW-PFEQFJNWSA-N. The full InChI is InChI=1S/C14H15N.ClH/c1-10-6-7-13(14-8-9-15-14)12-5-3-2-4-11(10)12;/h2-7,14-15H,8-9H2,1H3;1H/t14-;/m1./s1.
What are the key properties of (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride?
(2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride has a molecular weight of 233.74 g/mol, XLogP of 3.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylnaphthalen-1-yl)azetidine;hydrochloride is sourced from PubChem (CID 171197351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).