N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine

C17H26N4O — CID 46998669

IUPACN-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine
SMILESCOCCn1ccnc1CN(Cc1ccccn1)CC(C)C
InChIInChI=1S/C17H26N4O/c1-15(2)12-20(13-16-6-4-5-7-18-16)14-17-19-8-9-21(17)10-11-22-3/h4-9,15H,10-14H2,1-3H3
InChIKeyMFWIDBYBGALLNI-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.58
Rot. Bonds9

About N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine

N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine (PubChem CID 46998669) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine
PubChem CID46998669
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine
SMILESCOCCn1ccnc1CN(Cc1ccccn1)CC(C)C
InChIInChI=1S/C17H26N4O/c1-15(2)12-20(13-16-6-4-5-7-18-16)14-17-19-8-9-21(17)10-11-22-3/h4-9,15H,10-14H2,1-3H3
InChIKeyMFWIDBYBGALLNI-UHFFFAOYSA-N
XLogP2.58
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-(4-methoxyphenyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine
CID 46994572
N-[2-(4-chlorophenoxy)ethyl]-2-methoxy-N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]ethanamine
CID 131896758
ethane;2-ethyl-1-(2-methoxyethyl)imidazole
CID 164585283
(2S)-2-[[1-(2-methoxyethyl)imidazol-2-yl]methyl-methylamino]propanoic acid
CID 131905578
N'-(2-methoxyethyl)-N'-(2-methylpropyl)-N-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 62555011
(2R)-N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-N-(pyridin-3-ylmethyl)butan-2-amine
CID 94600630
3-(2,3-dimethoxypropoxy)-2-methoxy-N,N-bis(pyridin-2-ylmethyl)propan-1-amine
CID 132519369
N-methyl-N'-[(1-methylimidazol-2-yl)methyl]-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 58225638
2-[[2-methylpropyl(pyridin-2-ylmethyl)amino]methyl]benzoic acid
CID 46982647
2-[1-(2-methoxyethyl)imidazol-2-yl]ethanamine
CID 62410004
2-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-N-(pyridin-2-ylmethyl)propan-1-amine
CID 46988375
N'-[(1-methylimidazol-2-yl)methyl]-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 102196143

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine?
The IUPAC name of N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine (CID 46998669) is N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine.
What is the SMILES notation for N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine?
The canonical SMILES for N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine is COCCn1ccnc1CN(Cc1ccccn1)CC(C)C.
What is the InChIKey of N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine?
The InChIKey is MFWIDBYBGALLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-15(2)12-20(13-16-6-4-5-7-18-16)14-17-19-8-9-21(17)10-11-22-3/h4-9,15H,10-14H2,1-3H3.
What are the key properties of N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine?
N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine has a molecular weight of 302.42 g/mol, XLogP of 2.58, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 46998669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).