2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline

C13H15N — CID 176972170

IUPAC2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline
SMILESCC(C)c1ccc2c(n1)=CC1CC1C=2
InChIInChI=1S/C13H15N/c1-8(2)12-4-3-9-5-10-6-11(10)7-13(9)14-12/h3-5,7-8,10-11H,6H2,1-2H3
InChIKeyOWISNUWJATWPBT-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.42
Rot. Bonds1

About 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline

2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline (PubChem CID 176972170) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline.

Molecular Properties

Compound Name2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline
PubChem CID176972170
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC Name2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline
SMILESCC(C)c1ccc2c(n1)=CC1CC1C=2
InChIInChI=1S/C13H15N/c1-8(2)12-4-3-9-5-10-6-11(10)7-13(9)14-12/h3-5,7-8,10-11H,6H2,1-2H3
InChIKeyOWISNUWJATWPBT-UHFFFAOYSA-N
XLogP1.42
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-Ethyl-2-(2,2,2-trifluoroethyl)-6,7-dihydroquinoline
CID 143910935
6-Ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline
CID 143910995
1,6-Dimethyl-6,7-dihydroisoquinoline
CID 58717366
2-methyl-9bH-benzo[de]quinoline
CID 58939804
(2E,3Z)-2,3-di(ethylidene)quinoline
CID 59760794
2-Ethyl-4-methyl-4,4a-dihydroquinoline
CID 66608600
N-(6-methylcyclohexa-1,3-dien-1-yl)-6-methylidenecyclohex-2-en-1-imine
CID 68004378
2-Methyl-6,7-dihydroquinoline
CID 68373323
2,3-Di(ethylidene)quinoline
CID 72554674
2-Ethyl-4,4a-dihydroquinoline
CID 89423862
2,7-Dimethyl-6,7-dihydroquinoline
CID 89495201
2,3-Dimethyl-6,7-dihydroquinoline
CID 89495202

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline?
The IUPAC name of 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline (CID 176972170) is 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline.
What is the SMILES notation for 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline?
The canonical SMILES for 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline is CC(C)c1ccc2c(n1)=CC1CC1C=2.
What is the InChIKey of 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline?
The InChIKey is OWISNUWJATWPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N/c1-8(2)12-4-3-9-5-10-6-11(10)7-13(9)14-12/h3-5,7-8,10-11H,6H2,1-2H3.
What are the key properties of 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline?
2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline has a molecular weight of 185.27 g/mol, XLogP of 1.42, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-6,6a-dihydro-5aH-cyclopropa[g]quinoline is sourced from PubChem (CID 176972170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).