(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride

C14H17ClN2 — CID 171216952

IUPAC(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc2ccccc2n1)C1CCC1
InChIInChI=1S/C14H16N2.ClH/c15-14(11-5-3-6-11)13-9-8-10-4-1-2-7-12(10)16-13;/h1-2,4,7-9,11,14H,3,5-6,15H2;1H/t14-;/m1./s1
InChIKeyTYYCAZCSMSKUDP-PFEQFJNWSA-N
MW248.76 g/mol
LogP3.46
Rot. Bonds2

About (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride

(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride (PubChem CID 171216952) has the molecular formula C14H17ClN2 and a molecular weight of 248.76 g/mol. Its IUPAC name is (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride
PubChem CID171216952
Molecular FormulaC14H17ClN2
Molecular Weight248.76 g/mol
Exact Mass248.11
IUPAC Name(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc2ccccc2n1)C1CCC1
InChIInChI=1S/C14H16N2.ClH/c15-14(11-5-3-6-11)13-9-8-10-4-1-2-7-12(10)16-13;/h1-2,4,7-9,11,14H,3,5-6,15H2;1H/t14-;/m1./s1
InChIKeyTYYCAZCSMSKUDP-PFEQFJNWSA-N
XLogP3.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.76
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-1-quinolin-2-ylethanamine
CID 63222470
(1S)-1-quinolin-2-ylethanamine;hydrochloride
CID 171236571
(1R)-1-quinolin-2-ylethanamine;hydrochloride
CID 171216934
(2-phenylcyclopropyl)-quinolin-2-ylmethanamine
CID 116517494
amino(quinolin-2-yl)methanol
CID 154237779
(1S)-1-quinolin-2-ylpropan-1-amine;hydrochloride
CID 171236572
2-[(R)-cyclopentyl(piperazin-1-yl)methyl]quinoline;dihydrochloride
CID 171297216
2-[(S)-cyclohexyl(piperazin-1-yl)methyl]quinoline;dihydrochloride
CID 171284597
2-cyclopropyl-2-quinolin-2-ylacetonitrile
CID 175668506
2-(1-chloroethyl)quinoline
CID 14750485
cyclohexyl-(6-methyl-2-pyridinyl)methanamine
CID 63555597
(S)-cyclohexyl-(6-methyl-2-pyridinyl)methanamine
CID 96644387

Frequently Asked Questions

What is the IUPAC name of (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride?
The IUPAC name of (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride (CID 171216952) is (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride.
What is the SMILES notation for (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride?
The canonical SMILES for (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride is Cl.N[C@@H](c1ccc2ccccc2n1)C1CCC1.
What is the InChIKey of (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride?
The InChIKey is TYYCAZCSMSKUDP-PFEQFJNWSA-N. The full InChI is InChI=1S/C14H16N2.ClH/c15-14(11-5-3-6-11)13-9-8-10-4-1-2-7-12(10)16-13;/h1-2,4,7-9,11,14H,3,5-6,15H2;1H/t14-;/m1./s1.
What are the key properties of (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride?
(R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride has a molecular weight of 248.76 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclobutyl(quinolin-2-yl)methanamine;hydrochloride is sourced from PubChem (CID 171216952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).