2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine

C15H29N3O — CID 112591974

IUPAC2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine
SMILESCc1ncc(CNCC(C)C)n1CCOC(C)(C)C
InChIInChI=1S/C15H29N3O/c1-12(2)9-16-10-14-11-17-13(3)18(14)7-8-19-15(4,5)6/h11-12,16H,7-10H2,1-6H3
InChIKeyQKTSUXXUGKGTKO-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.75
Rot. Bonds7

About 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine

2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine (PubChem CID 112591974) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine
PubChem CID112591974
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine
SMILESCc1ncc(CNCC(C)C)n1CCOC(C)(C)C
InChIInChI=1S/C15H29N3O/c1-12(2)9-16-10-14-11-17-13(3)18(14)7-8-19-15(4,5)6/h11-12,16H,7-10H2,1-6H3
InChIKeyQKTSUXXUGKGTKO-UHFFFAOYSA-N
XLogP2.75
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine with MolForge

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Related Compounds

N-[[3-(4-methoxybutyl)-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 104649983
2-methyl-N-[[2-methyl-3-[3-(2,2,2-trifluoroethoxy)propyl]imidazol-4-yl]methyl]propan-1-amine
CID 65172339
2-methyl-N-[[2-methyl-3-[2-(trifluoromethylsulfanyl)ethyl]imidazol-4-yl]methyl]propan-1-amine
CID 116627167
N-[[2-methyl-3-(2-propan-2-yloxyethyl)imidazol-4-yl]methyl]ethanamine
CID 65173082
2-methyl-N-[[2-methyl-3-(3-methylbutyl)imidazol-4-yl]methyl]propan-2-amine
CID 65172070
N-[[3-[(4-fluorophenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 65172235
2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]triazol-4-yl]methyl]propan-1-amine
CID 62457361
N-[[3-[(4-fluoro-2-methylphenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 114349347
N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 65171777
N-[[2-methyl-3-[2-(2-methylpropoxy)ethyl]imidazol-4-yl]methyl]cyclopropanamine
CID 106458362
2-methyl-N-[[6-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-3-pyridinyl]methyl]propan-1-amine
CID 115942783
N-[(3-butyl-2-methylimidazol-4-yl)methyl]ethanamine
CID 65172409

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine (CID 112591974) is 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine is Cc1ncc(CNCC(C)C)n1CCOC(C)(C)C.
What is the InChIKey of 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine?
The InChIKey is QKTSUXXUGKGTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-12(2)9-16-10-14-11-17-13(3)18(14)7-8-19-15(4,5)6/h11-12,16H,7-10H2,1-6H3.
What are the key properties of 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine?
2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine is sourced from PubChem (CID 112591974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).