2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol

C17H27N3O — CID 109380142

IUPAC2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol
SMILESCc1ccc2ncc(CNCC(C)(C)C(O)C(C)C)n2c1
InChIInChI=1S/C17H27N3O/c1-12(2)16(21)17(4,5)11-18-8-14-9-19-15-7-6-13(3)10-20(14)15/h6-7,9-10,12,16,18,21H,8,11H2,1-5H3
InChIKeyLNYHNQNEOPCXPB-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.78
Rot. Bonds6

About 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol

2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol (PubChem CID 109380142) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol.

Molecular Properties

Compound Name2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol
PubChem CID109380142
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol
SMILESCc1ccc2ncc(CNCC(C)(C)C(O)C(C)C)n2c1
InChIInChI=1S/C17H27N3O/c1-12(2)16(21)17(4,5)11-18-8-14-9-19-15-7-6-13(3)10-20(14)15/h6-7,9-10,12,16,18,21H,8,11H2,1-5H3
InChIKeyLNYHNQNEOPCXPB-UHFFFAOYSA-N
XLogP2.78
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol with MolForge

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Related Compounds

(2R)-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]propan-2-ol
CID 103884204
2-methyl-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]propan-2-amine
CID 115747139
2,2-dimethyl-1-(6-methylimidazo[1,2-a]pyridin-3-yl)propan-1-amine
CID 82029081
3-[[(2,2-diethyl-4-hydroxybutyl)amino]methyl]imidazo[1,2-a]pyridine-6-carbonitrile
CID 111498712
N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-quinolin-8-ylmethanamine
CID 166202189
3-[[(3-hydroxy-4-methylpentyl)amino]methyl]imidazo[1,2-a]pyridine-6-carbonitrile
CID 111468076
2-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]-2-(3,4,5-trifluorophenyl)ethanol
CID 109380311
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine
CID 115651962
N,6-dimethylimidazo[1,2-a]pyridin-3-amine
CID 166460733
4-[(dimethylamino)methyl]-N-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyridin-2-amine
CID 86782883
3-[4-[[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]phenyl]-1,3-oxazolidin-2-one
CID 84600673
2-methoxy-5-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pyridine-3-carboxamide
CID 75447144

Frequently Asked Questions

What is the IUPAC name of 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol?
The IUPAC name of 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol (CID 109380142) is 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol.
What is the SMILES notation for 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol?
The canonical SMILES for 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol is Cc1ccc2ncc(CNCC(C)(C)C(O)C(C)C)n2c1.
What is the InChIKey of 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol?
The InChIKey is LNYHNQNEOPCXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-12(2)16(21)17(4,5)11-18-8-14-9-19-15-7-6-13(3)10-20(14)15/h6-7,9-10,12,16,18,21H,8,11H2,1-5H3.
What are the key properties of 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol?
2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol has a molecular weight of 289.42 g/mol, XLogP of 2.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4-trimethyl-1-[(6-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-3-ol is sourced from PubChem (CID 109380142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).