spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]

C11H15N — CID 142548997

IUPACspiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]
SMILESC1=NC2=C(CC1)CC1(CC2)CC1
InChIInChI=1S/C11H15N/c1-2-9-8-11(5-6-11)4-3-10(9)12-7-1/h7H,1-6,8H2
InChIKeyYCSRKTXENNCAIE-UHFFFAOYSA-N
MW161.25 g/mol
LogP3.07
Rot. Bonds

About spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]

spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] (PubChem CID 142548997) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane].

Molecular Properties

Compound Namespiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]
PubChem CID142548997
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Namespiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]
SMILESC1=NC2=C(CC1)CC1(CC2)CC1
InChIInChI=1S/C11H15N/c1-2-9-8-11(5-6-11)4-3-10(9)12-7-1/h7H,1-6,8H2
InChIKeyYCSRKTXENNCAIE-UHFFFAOYSA-N
XLogP3.07
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] with MolForge

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Related Compounds

4-Methyl-3,4,5,6,7,8-hexahydroquinoline
CID 89313200
ethane;spiro[4,5,6,8-tetrahydro-3H-quinoline-7,1'-cyclopropane]
CID 142548989
ethane;spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]
CID 142548996
ethane;N-(7-methylspiro[2.5]oct-6-en-6-yl)ethanimine
CID 142549075
8-Methyl-3,4,5,6,7,8-hexahydroquinoline
CID 143913712
3,4,5,5a,6,6a-Hexahydrocyclopropa[g]indole
CID 164042423
6-Methyl-3,4,5,6,7,8-hexahydroquinoline
CID 166901327
6-Propan-2-yl-3,4,5,6,7,8-hexahydroquinoline
CID 169977751
spiro[4,5,6,8-tetrahydro-3H-quinoline-7,1'-cyclopropane]
CID 142548990
N-(7-methylspiro[2.5]oct-6-en-6-yl)ethanimine
CID 142549076
N-(4,4-dimethyl-2-propan-2-ylcyclohexen-1-yl)ethanimine
CID 144383735

Frequently Asked Questions

What is the IUPAC name of spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]?
The IUPAC name of spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] (CID 142548997) is spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane].
What is the SMILES notation for spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]?
The canonical SMILES for spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] is C1=NC2=C(CC1)CC1(CC2)CC1.
What is the InChIKey of spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]?
The InChIKey is YCSRKTXENNCAIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-2-9-8-11(5-6-11)4-3-10(9)12-7-1/h7H,1-6,8H2.
What are the key properties of spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane]?
spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] has a molecular weight of 161.25 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[4,5,7,8-tetrahydro-3H-quinoline-6,1'-cyclopropane] is sourced from PubChem (CID 142548997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).