4-propan-2-yl-6,7-dihydroquinoline

C12H15N — CID 142610944

IUPAC4-propan-2-yl-6,7-dihydroquinoline
SMILESCC(C)c1ccnc2c1=CCCC=2
InChIInChI=1S/C12H15N/c1-9(2)10-7-8-13-12-6-4-3-5-11(10)12/h5-9H,3-4H2,1-2H3
InChIKeyXHMBYGNXMVAQSY-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.56
Rot. Bonds1

About 4-propan-2-yl-6,7-dihydroquinoline

4-propan-2-yl-6,7-dihydroquinoline (PubChem CID 142610944) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-propan-2-yl-6,7-dihydroquinoline.

Molecular Properties

Compound Name4-propan-2-yl-6,7-dihydroquinoline
PubChem CID142610944
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4-propan-2-yl-6,7-dihydroquinoline
SMILESCC(C)c1ccnc2c1=CCCC=2
InChIInChI=1S/C12H15N/c1-9(2)10-7-8-13-12-6-4-3-5-11(10)12/h5-9H,3-4H2,1-2H3
InChIKeyXHMBYGNXMVAQSY-UHFFFAOYSA-N
XLogP1.56
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4a,5,6,7-Tetrahydroquinoline
CID 77755842
Dihydrodibenzazepine
CID 87126010
7,7-Dimethylquinoline
CID 129752244
7-Fluoro-6-propan-2-yl-6,7-dihydroquinoline
CID 89318114
8-Fluoro-4-propyl-6,7-dihydroquinoline
CID 123389573
4,5-Difluoro-7-methyl-6,7-dihydroquinoline
CID 147742277
8-Fluoro-4-propan-2-yl-6,7-dihydroquinoline
CID 168883126
10a,10b-Dihydrobenzo[f]quinoline
CID 91482637
8-Methyl-4a,8a-dihydroquinoline
CID 20772220
9bH-benzo[de]quinoline
CID 57001454
4-methyl-8H-quinolin-8-ide;yttrium
CID 59017481
8-Methyl-6,7-dihydroquinoline
CID 66607842

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-6,7-dihydroquinoline?
The IUPAC name of 4-propan-2-yl-6,7-dihydroquinoline (CID 142610944) is 4-propan-2-yl-6,7-dihydroquinoline.
What is the SMILES notation for 4-propan-2-yl-6,7-dihydroquinoline?
The canonical SMILES for 4-propan-2-yl-6,7-dihydroquinoline is CC(C)c1ccnc2c1=CCCC=2.
What is the InChIKey of 4-propan-2-yl-6,7-dihydroquinoline?
The InChIKey is XHMBYGNXMVAQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-9(2)10-7-8-13-12-6-4-3-5-11(10)12/h5-9H,3-4H2,1-2H3.
What are the key properties of 4-propan-2-yl-6,7-dihydroquinoline?
4-propan-2-yl-6,7-dihydroquinoline has a molecular weight of 173.26 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-6,7-dihydroquinoline is sourced from PubChem (CID 142610944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).