N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine

C15H29N3O2 — CID 103413583

IUPACN-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCOCCOCCCn1c(CNC(C)(C)C)cnc1C
InChIInChI=1S/C15H29N3O2/c1-13-16-11-14(12-17-15(2,3)4)18(13)7-6-8-20-10-9-19-5/h11,17H,6-10,12H2,1-5H3
InChIKeySJBPQEPYFUACNO-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.13
Rot. Bonds9

About N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine

N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine (PubChem CID 103413583) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine
PubChem CID103413583
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCOCCOCCCn1c(CNC(C)(C)C)cnc1C
InChIInChI=1S/C15H29N3O2/c1-13-16-11-14(12-17-15(2,3)4)18(13)7-6-8-20-10-9-19-5/h11,17H,6-10,12H2,1-5H3
InChIKeySJBPQEPYFUACNO-UHFFFAOYSA-N
XLogP2.13
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-isobutyl-N'-{2-[1-(2-methoxyethyl)-5-methyl-1H-imidazol-2-yl]ethyl}urea
CID 91923946
1-(3-Methoxypropyl)-5-methyl-2-(pyrrolidin-3-YL)-1H-imidazole
CID 86820588
2-[1-(2-Methoxyethyl)-5-methyl-1H-imidazol-2-YL]ethan-1-amine
CID 86820595
4-(2-methoxyethoxy)-1-[(1-methyl-1H-imidazol-5-yl)methyl]piperidine
CID 90648579
N-[(3-methylimidazol-4-yl)methyl]-3-morpholin-4-ylbutan-2-amine
CID 119123822
1-[2-(1-Cyclobutyl-5-methyl-1H-imidazol-2-YL)ethyl]-3-(3-methoxypropyl)urea
CID 124062623
(2S)-N-[(1-ethylimidazol-4-yl)methyl]-3-methoxybutan-2-amine
CID 138020874
N-[(3-methylimidazol-4-yl)methyl]-2-(2,2,2-trifluoroethoxy)ethanamine
CID 63000850
N,N,1-trimethyl-5-[[2-(2,2,2-trifluoroethoxy)ethylamino]methyl]imidazol-2-amine
CID 64012180
2-methyl-N-[[2-methyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazol-4-yl]methyl]propan-2-amine
CID 65171670
2-methyl-N-[[2-methyl-3-[3-(2,2,2-trifluoroethoxy)propyl]imidazol-4-yl]methyl]propan-2-amine
CID 65171672
N-[[2-methyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazol-4-yl]methyl]propan-2-amine
CID 65171710

Frequently Asked Questions

What is the IUPAC name of N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine (CID 103413583) is N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine is COCCOCCCn1c(CNC(C)(C)C)cnc1C.
What is the InChIKey of N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is SJBPQEPYFUACNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-13-16-11-14(12-17-15(2,3)4)18(13)7-6-8-20-10-9-19-5/h11,17H,6-10,12H2,1-5H3.
What are the key properties of N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine?
N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 2.13, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[3-(2-methoxyethoxy)propyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 103413583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).