ethane;5-ethylquinoline

C13H17N — CID 143401043

IUPACethane;5-ethylquinoline
SMILESCC.CCc1cccc2ncccc12
InChIInChI=1S/C11H11N.C2H6/c1-2-9-5-3-7-11-10(9)6-4-8-12-11;1-2/h3-8H,2H2,1H3;1-2H3
InChIKeyGAFNZFIXGTWSAV-UHFFFAOYSA-N
MW187.29 g/mol
LogP3.82
Rot. Bonds1

About ethane;5-ethylquinoline

ethane;5-ethylquinoline (PubChem CID 143401043) has the molecular formula C13H17N and a molecular weight of 187.29 g/mol. Its IUPAC name is ethane;5-ethylquinoline.

Molecular Properties

Compound Nameethane;5-ethylquinoline
PubChem CID143401043
Molecular FormulaC13H17N
Molecular Weight187.29 g/mol
Exact Mass187.14
IUPAC Nameethane;5-ethylquinoline
SMILESCC.CCc1cccc2ncccc12
InChIInChI=1S/C11H11N.C2H6/c1-2-9-5-3-7-11-10(9)6-4-8-12-11;1-2/h3-8H,2H2,1H3;1-2H3
InChIKeyGAFNZFIXGTWSAV-UHFFFAOYSA-N
XLogP3.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;N-methyl-1-quinolin-5-ylmethanamine
CID 163296401
ethane;1,5-naphthyridine;propane
CID 142434189
[(3-ethyl-2-pyridinyl)-quinolin-5-ylmethyl]hydrazine
CID 105263880
N-methyl-2-quinolin-5-ylethanamine
CID 76694367
N-(quinolin-5-ylmethyl)butan-2-amine
CID 62340535
4,5-diethylquinoline
CID 154662761
5-bromoquinoline;ethane
CID 142484600
3-quinolin-5-ylpropanoic acid
CID 81224223
ethane;3-ethyl-2-methylpyridine
CID 143071594
5-ethylcinnoline
CID 147224784
N-propyl-1-quinolin-5-ylhexan-3-amine
CID 81221861
(2-quinolin-5-ylphenyl)methanol
CID 172649381

Frequently Asked Questions

What is the IUPAC name of ethane;5-ethylquinoline?
The IUPAC name of ethane;5-ethylquinoline (CID 143401043) is ethane;5-ethylquinoline.
What is the SMILES notation for ethane;5-ethylquinoline?
The canonical SMILES for ethane;5-ethylquinoline is CC.CCc1cccc2ncccc12.
What is the InChIKey of ethane;5-ethylquinoline?
The InChIKey is GAFNZFIXGTWSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N.C2H6/c1-2-9-5-3-7-11-10(9)6-4-8-12-11;1-2/h3-8H,2H2,1H3;1-2H3.
What are the key properties of ethane;5-ethylquinoline?
ethane;5-ethylquinoline has a molecular weight of 187.29 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethylquinoline is sourced from PubChem (CID 143401043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).