7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane

C19H25N — CID 170732956

IUPAC7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane
SMILESCCC.CCC1=CC(C)Cc2c1ccc1cccnc21
InChIInChI=1S/C16H17N.C3H8/c1-3-12-9-11(2)10-15-14(12)7-6-13-5-4-8-17-16(13)15;1-3-2/h4-9,11H,3,10H2,1-2H3;3H2,1-2H3
InChIKeyODZXKAHPCKZWDW-UHFFFAOYSA-N
MW267.42 g/mol
LogP5.64
Rot. Bonds1

About 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane

7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane (PubChem CID 170732956) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane.

Molecular Properties

Compound Name7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane
PubChem CID170732956
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane
SMILESCCC.CCC1=CC(C)Cc2c1ccc1cccnc21
InChIInChI=1S/C16H17N.C3H8/c1-3-12-9-11(2)10-15-14(12)7-6-13-5-4-8-17-16(13)15;1-3-2/h4-9,11H,3,10H2,1-2H3;3H2,1-2H3
InChIKeyODZXKAHPCKZWDW-UHFFFAOYSA-N
XLogP5.64
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.42
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane?
The IUPAC name of 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane (CID 170732956) is 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane.
What is the SMILES notation for 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane?
The canonical SMILES for 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane is CCC.CCC1=CC(C)Cc2c1ccc1cccnc21.
What is the InChIKey of 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane?
The InChIKey is ODZXKAHPCKZWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N.C3H8/c1-3-12-9-11(2)10-15-14(12)7-6-13-5-4-8-17-16(13)15;1-3-2/h4-9,11H,3,10H2,1-2H3;3H2,1-2H3.
What are the key properties of 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane?
7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane has a molecular weight of 267.42 g/mol, XLogP of 5.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane is sourced from PubChem (CID 170732956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).