(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride

C15H18ClNO — CID 171212946

IUPAC(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride
SMILESCOc1ccc2ccccc2c1[C@H](N)C1CC1.Cl
InChIInChI=1S/C15H17NO.ClH/c1-17-13-9-8-10-4-2-3-5-12(10)14(13)15(16)11-6-7-11;/h2-5,8-9,11,15H,6-7,16H2,1H3;1H/t15-;/m1./s1
InChIKeyXGDHTPNNJBWLJL-XFULWGLBSA-N
MW263.77 g/mol
LogP3.68
Rot. Bonds3

About (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride

(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride (PubChem CID 171212946) has the molecular formula C15H18ClNO and a molecular weight of 263.77 g/mol. Its IUPAC name is (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride
PubChem CID171212946
Molecular FormulaC15H18ClNO
Molecular Weight263.77 g/mol
Exact Mass263.11
IUPAC Name(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride
SMILESCOc1ccc2ccccc2c1[C@H](N)C1CC1.Cl
InChIInChI=1S/C15H17NO.ClH/c1-17-13-9-8-10-4-2-3-5-12(10)14(13)15(16)11-6-7-11;/h2-5,8-9,11,15H,6-7,16H2,1H3;1H/t15-;/m1./s1
InChIKeyXGDHTPNNJBWLJL-XFULWGLBSA-N
XLogP3.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride?
The IUPAC name of (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride (CID 171212946) is (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride.
What is the SMILES notation for (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride?
The canonical SMILES for (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride is COc1ccc2ccccc2c1[C@H](N)C1CC1.Cl.
What is the InChIKey of (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride?
The InChIKey is XGDHTPNNJBWLJL-XFULWGLBSA-N. The full InChI is InChI=1S/C15H17NO.ClH/c1-17-13-9-8-10-4-2-3-5-12(10)14(13)15(16)11-6-7-11;/h2-5,8-9,11,15H,6-7,16H2,1H3;1H/t15-;/m1./s1.
What are the key properties of (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride?
(R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride has a molecular weight of 263.77 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclopropyl-(2-methoxynaphthalen-1-yl)methanamine;hydrochloride is sourced from PubChem (CID 171212946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).