3-methylquinoline;pentane

C15H21N — CID 145470784

IUPAC3-methylquinoline;pentane
SMILESCCCCC.Cc1cnc2ccccc2c1
InChIInChI=1S/C10H9N.C5H12/c1-8-6-9-4-2-3-5-10(9)11-7-8;1-3-5-4-2/h2-7H,1H3;3-5H2,1-2H3
InChIKeyJPOGQOUGMKLRDP-UHFFFAOYSA-N
MW215.34 g/mol
LogP4.74
Rot. Bonds2

About 3-methylquinoline;pentane

3-methylquinoline;pentane (PubChem CID 145470784) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-methylquinoline;pentane.

Molecular Properties

Compound Name3-methylquinoline;pentane
PubChem CID145470784
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name3-methylquinoline;pentane
SMILESCCCCC.Cc1cnc2ccccc2c1
InChIInChI=1S/C10H9N.C5H12/c1-8-6-9-4-2-3-5-10(9)11-7-8;1-3-5-4-2/h2-7H,1H3;3-5H2,1-2H3
InChIKeyJPOGQOUGMKLRDP-UHFFFAOYSA-N
XLogP4.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethylnaphthalene;3-methylquinoline
CID 143066870
3-butylsulfanylquinoline
CID 118174551
acridine;heptane
CID 158562494
1-quinolin-3-yloctan-1-one
CID 114963108
N-heptan-3-ylquinolin-3-amine
CID 63947322
7-[(E)-hex-1-enyl]-3-methylquinoline
CID 176872184
butyl quinoline-3-carboxylate
CID 54753708
3-methyl-7-propoxyquinoline
CID 68611316
2-fluoro-4-methylpyridine;5-methylpyrimidine;3-methylquinoline
CID 157381211
1-quinolin-3-ylbutan-1-ol
CID 60924193
2-butyl-3-methylquinoline
CID 519104
1-quinolin-3-ylnonylhydrazine
CID 105286952

Frequently Asked Questions

What is the IUPAC name of 3-methylquinoline;pentane?
The IUPAC name of 3-methylquinoline;pentane (CID 145470784) is 3-methylquinoline;pentane.
What is the SMILES notation for 3-methylquinoline;pentane?
The canonical SMILES for 3-methylquinoline;pentane is CCCCC.Cc1cnc2ccccc2c1.
What is the InChIKey of 3-methylquinoline;pentane?
The InChIKey is JPOGQOUGMKLRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.C5H12/c1-8-6-9-4-2-3-5-10(9)11-7-8;1-3-5-4-2/h2-7H,1H3;3-5H2,1-2H3.
What are the key properties of 3-methylquinoline;pentane?
3-methylquinoline;pentane has a molecular weight of 215.34 g/mol, XLogP of 4.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylquinoline;pentane is sourced from PubChem (CID 145470784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).