(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride

C16H20ClNO — CID 171246772

IUPAC(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc2ccccc2c1)C1CCOCC1
InChIInChI=1S/C16H19NO.ClH/c17-16(13-7-9-18-10-8-13)15-6-5-12-3-1-2-4-14(12)11-15;/h1-6,11,13,16H,7-10,17H2;1H/t16-;/m1./s1
InChIKeyOFQWWEWHDXSQPP-PKLMIRHRSA-N
MW277.80 g/mol
LogP3.69
Rot. Bonds2

About (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride

(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride (PubChem CID 171246772) has the molecular formula C16H20ClNO and a molecular weight of 277.80 g/mol. Its IUPAC name is (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride
PubChem CID171246772
Molecular FormulaC16H20ClNO
Molecular Weight277.80 g/mol
Exact Mass277.12
IUPAC Name(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc2ccccc2c1)C1CCOCC1
InChIInChI=1S/C16H19NO.ClH/c17-16(13-7-9-18-10-8-13)15-6-5-12-3-1-2-4-14(12)11-15;/h1-6,11,13,16H,7-10,17H2;1H/t16-;/m1./s1
InChIKeyOFQWWEWHDXSQPP-PKLMIRHRSA-N
XLogP3.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-naphthalen-2-yl(oxan-4-yl)methanamine
CID 171246771
cyclohexyl(naphthalen-2-yl)methanamine
CID 62715199
4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol
CID 116941899
(R)-1H-indol-6-yl(oxan-4-yl)methanamine;hydrochloride
CID 171248195
(S)-(3-chlorophenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171239392
(S)-(3,4-diphenoxyphenyl)-(oxan-4-yl)methanamine
CID 171238967
oxan-4-yl-(4-phenoxyphenyl)methanamine
CID 62906011
(3,4-dichlorophenyl)-(oxan-4-yl)methanamine
CID 62906187
(S)-(3,4-dimethylphenyl)-(oxan-4-yl)methanamine
CID 94891825
(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine
CID 171244179
(3-bromophenyl)-(oxan-4-yl)methanamine
CID 63934860
(S)-(3-fluorophenyl)-(oxan-4-yl)methanamine
CID 95255362

Frequently Asked Questions

What is the IUPAC name of (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride?
The IUPAC name of (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride (CID 171246772) is (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride.
What is the SMILES notation for (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride?
The canonical SMILES for (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride is Cl.N[C@@H](c1ccc2ccccc2c1)C1CCOCC1.
What is the InChIKey of (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride?
The InChIKey is OFQWWEWHDXSQPP-PKLMIRHRSA-N. The full InChI is InChI=1S/C16H19NO.ClH/c17-16(13-7-9-18-10-8-13)15-6-5-12-3-1-2-4-14(12)11-15;/h1-6,11,13,16H,7-10,17H2;1H/t16-;/m1./s1.
What are the key properties of (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride?
(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride is sourced from PubChem (CID 171246772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).