6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine

C12H15ClN2 — CID 105480189

IUPAC6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine
SMILESCN1CCC2(CC2N)c2cc(Cl)ccc21
InChIInChI=1S/C12H15ClN2/c1-15-5-4-12(7-11(12)14)9-6-8(13)2-3-10(9)15/h2-3,6,11H,4-5,7,14H2,1H3
InChIKeyYUZUFUMZWGVBNB-UHFFFAOYSA-N
MW222.72 g/mol
LogP2.15
Rot. Bonds

About 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine

6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine (PubChem CID 105480189) has the molecular formula C12H15ClN2 and a molecular weight of 222.72 g/mol. Its IUPAC name is 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine.

Molecular Properties

Compound Name6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine
PubChem CID105480189
Molecular FormulaC12H15ClN2
Molecular Weight222.72 g/mol
Exact Mass222.09
IUPAC Name6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine
SMILESCN1CCC2(CC2N)c2cc(Cl)ccc21
InChIInChI=1S/C12H15ClN2/c1-15-5-4-12(7-11(12)14)9-6-8(13)2-3-10(9)15/h2-3,6,11H,4-5,7,14H2,1H3
InChIKeyYUZUFUMZWGVBNB-UHFFFAOYSA-N
XLogP2.15
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.72
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine?
The IUPAC name of 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine (CID 105480189) is 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine.
What is the SMILES notation for 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine?
The canonical SMILES for 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine is CN1CCC2(CC2N)c2cc(Cl)ccc21.
What is the InChIKey of 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine?
The InChIKey is YUZUFUMZWGVBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2/c1-15-5-4-12(7-11(12)14)9-6-8(13)2-3-10(9)15/h2-3,6,11H,4-5,7,14H2,1H3.
What are the key properties of 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine?
6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine has a molecular weight of 222.72 g/mol, XLogP of 2.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1-methylspiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1'-amine is sourced from PubChem (CID 105480189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).