(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride

C15H20ClN3 — CID 171314768

IUPAC(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccnc2ccccc12)C1CCNCC1
InChIInChI=1S/C15H19N3.ClH/c16-15(11-5-8-17-9-6-11)13-7-10-18-14-4-2-1-3-12(13)14;/h1-4,7,10-11,15,17H,5-6,8-9,16H2;1H/t15-;/m1./s1
InChIKeyDJFCUIJMHUNCFH-XFULWGLBSA-N
MW277.80 g/mol
LogP2.66
Rot. Bonds2

About (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride

(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride (PubChem CID 171314768) has the molecular formula C15H20ClN3 and a molecular weight of 277.80 g/mol. Its IUPAC name is (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride
PubChem CID171314768
Molecular FormulaC15H20ClN3
Molecular Weight277.80 g/mol
Exact Mass277.13
IUPAC Name(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccnc2ccccc12)C1CCNCC1
InChIInChI=1S/C15H19N3.ClH/c16-15(11-5-8-17-9-6-11)13-7-10-18-14-4-2-1-3-12(13)14;/h1-4,7,10-11,15,17H,5-6,8-9,16H2;1H/t15-;/m1./s1
InChIKeyDJFCUIJMHUNCFH-XFULWGLBSA-N
XLogP2.66
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride?
The IUPAC name of (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride (CID 171314768) is (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride.
What is the SMILES notation for (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride?
The canonical SMILES for (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride is Cl.N[C@@H](c1ccnc2ccccc12)C1CCNCC1.
What is the InChIKey of (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride?
The InChIKey is DJFCUIJMHUNCFH-XFULWGLBSA-N. The full InChI is InChI=1S/C15H19N3.ClH/c16-15(11-5-8-17-9-6-11)13-7-10-18-14-4-2-1-3-12(13)14;/h1-4,7,10-11,15,17H,5-6,8-9,16H2;1H/t15-;/m1./s1.
What are the key properties of (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride?
(R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-piperidin-4-yl(quinolin-4-yl)methanamine;hydrochloride is sourced from PubChem (CID 171314768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).