ethane;5-methyl-2-propan-2-ylpyridine

C13H25N — CID 178109062

IUPACethane;5-methyl-2-propan-2-ylpyridine
SMILESCC.CC.Cc1ccc(C(C)C)nc1
InChIInChI=1S/C9H13N.2C2H6/c1-7(2)9-5-4-8(3)6-10-9;2*1-2/h4-7H,1-3H3;2*1-2H3
InChIKeyZKCTXCHWLFSBQL-UHFFFAOYSA-N
MW195.35 g/mol
LogP4.57
Rot. Bonds1

About ethane;5-methyl-2-propan-2-ylpyridine

ethane;5-methyl-2-propan-2-ylpyridine (PubChem CID 178109062) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is ethane;5-methyl-2-propan-2-ylpyridine.

Molecular Properties

Compound Nameethane;5-methyl-2-propan-2-ylpyridine
PubChem CID178109062
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Nameethane;5-methyl-2-propan-2-ylpyridine
SMILESCC.CC.Cc1ccc(C(C)C)nc1
InChIInChI=1S/C9H13N.2C2H6/c1-7(2)9-5-4-8(3)6-10-9;2*1-2/h4-7H,1-3H3;2*1-2H3
InChIKeyZKCTXCHWLFSBQL-UHFFFAOYSA-N
XLogP4.57
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1-fluoroethyl)-5-methylpyridine
CID 126491448
1-(5-methyl-2-pyridinyl)ethanamine;hydrochloride
CID 127263938
4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine
CID 63197672
5-methyl-2-pentan-2-ylpyridine
CID 121401028
2-(5-methyl-2-pyridinyl)propanamide
CID 67185954
2-[2,2-bis(4-methylphenyl)-1-(5-methyl-2-pyridinyl)ethyl]-5-methylpyridine
CID 101454963
4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-one
CID 63196750
2-(1-cyclobutylethyl)-5-methylpyridine
CID 121401029
2-methyl-5-propan-2-ylpyrazine;5-methyl-2-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carbonitrile
CID 167549650
ethane;2-(6-propan-2-yl-3-pyridinyl)propan-2-ol
CID 142544002
(2S)-2-bromo-2-(5-methyl-2-pyridinyl)acetaldehyde
CID 146197547
CID 171408447
CID 171408447

Frequently Asked Questions

What is the IUPAC name of ethane;5-methyl-2-propan-2-ylpyridine?
The IUPAC name of ethane;5-methyl-2-propan-2-ylpyridine (CID 178109062) is ethane;5-methyl-2-propan-2-ylpyridine.
What is the SMILES notation for ethane;5-methyl-2-propan-2-ylpyridine?
The canonical SMILES for ethane;5-methyl-2-propan-2-ylpyridine is CC.CC.Cc1ccc(C(C)C)nc1.
What is the InChIKey of ethane;5-methyl-2-propan-2-ylpyridine?
The InChIKey is ZKCTXCHWLFSBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.2C2H6/c1-7(2)9-5-4-8(3)6-10-9;2*1-2/h4-7H,1-3H3;2*1-2H3.
What are the key properties of ethane;5-methyl-2-propan-2-ylpyridine?
ethane;5-methyl-2-propan-2-ylpyridine has a molecular weight of 195.35 g/mol, XLogP of 4.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methyl-2-propan-2-ylpyridine is sourced from PubChem (CID 178109062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).