ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine

C15H24N2 — CID 91437982

IUPACethane;2-methyl-3-pentylimidazo[1,2-a]pyridine
SMILESCC.CCCCCc1c(C)nc2ccccn12
InChIInChI=1S/C13H18N2.C2H6/c1-3-4-5-8-12-11(2)14-13-9-6-7-10-15(12)13;1-2/h6-7,9-10H,3-5,8H2,1-2H3;1-2H3
InChIKeyDSBKJGMDKVNBPL-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.40
Rot. Bonds4

About ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine

ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine (PubChem CID 91437982) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Nameethane;2-methyl-3-pentylimidazo[1,2-a]pyridine
PubChem CID91437982
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Nameethane;2-methyl-3-pentylimidazo[1,2-a]pyridine
SMILESCC.CCCCCc1c(C)nc2ccccn12
InChIInChI=1S/C13H18N2.C2H6/c1-3-4-5-8-12-11(2)14-13-9-6-7-10-15(12)13;1-2/h6-7,9-10H,3-5,8H2,1-2H3;1-2H3
InChIKeyDSBKJGMDKVNBPL-UHFFFAOYSA-N
XLogP4.40
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxyethyl)-2-methylimidazo[1,2-a]pyridine
CID 130909325
1-[2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethyl]cyclopropan-1-amine
CID 105469138
3-(bromomethyl)-N-methyl-N-pentylimidazo[1,2-a]pyridin-2-amine
CID 107080119
2-methyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]pentan-2-amine
CID 115694989
2-ethyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]aniline
CID 43764503
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3-pyrazol-1-ylpropan-1-amine
CID 115674375
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]cyclohexanamine
CID 43755994
N-methyl-1-(2-methylimidazo[1,2-a]pyridin-3-yl)methanesulfonamide
CID 165446492
N-(3-methoxypropyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84565197
N-(4-ethylphenyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84569581
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N,N-bis(2-methylpropyl)propanamide
CID 84565205
2-ethyl-2-[(2-methylimidazo[1,2-a]pyridin-3-yl)methylamino]propane-1,3-diol
CID 107864934

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine?
The IUPAC name of ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine (CID 91437982) is ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine.
What is the SMILES notation for ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine?
The canonical SMILES for ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine is CC.CCCCCc1c(C)nc2ccccn12.
What is the InChIKey of ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine?
The InChIKey is DSBKJGMDKVNBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2.C2H6/c1-3-4-5-8-12-11(2)14-13-9-6-7-10-15(12)13;1-2/h6-7,9-10H,3-5,8H2,1-2H3;1-2H3.
What are the key properties of ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine?
ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine has a molecular weight of 232.37 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine is sourced from PubChem (CID 91437982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).