2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine

C17H21N5O — CID 166620898

IUPAC2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine
SMILESCCc1cnc(-c2ccc(-c3nccn3CCN(C)C)o2)nc1
InChIInChI=1S/C17H21N5O/c1-4-13-11-19-16(20-12-13)14-5-6-15(23-14)17-18-7-8-22(17)10-9-21(2)3/h5-8,11-12H,4,9-10H2,1-3H3
InChIKeyOXLVYISAELJEBV-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.72
Rot. Bonds6

About 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine

2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine (PubChem CID 166620898) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine
PubChem CID166620898
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine
SMILESCCc1cnc(-c2ccc(-c3nccn3CCN(C)C)o2)nc1
InChIInChI=1S/C17H21N5O/c1-4-13-11-19-16(20-12-13)14-5-6-15(23-14)17-18-7-8-22(17)10-9-21(2)3/h5-8,11-12H,4,9-10H2,1-3H3
InChIKeyOXLVYISAELJEBV-UHFFFAOYSA-N
XLogP2.72
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[2-(4-methoxyphenyl)pyrimidin-5-yl]imidazol-1-yl]-N,N-dimethylethanamine
CID 56745738
2-[2-(2-bromophenyl)imidazol-1-yl]-N,N-dimethylethanamine
CID 82562220
2-[5-(2-bromophenyl)furan-2-yl]-1-ethylimidazole
CID 14798611
2-(5-ethylfuran-2-yl)-1-(2-imidazol-1-ylethyl)imidazole
CID 56750457
N-methyl-1-[5-(1-propylimidazol-2-yl)furan-2-yl]methanamine
CID 106887317
1-(2-methoxyethyl)-2-(5-propylfuran-2-yl)imidazole
CID 56742593
5-ethyl-2-[1-[2-(furan-2-yl)ethyl]imidazol-2-yl]pyridine
CID 56867577
N-[3-[1-[2-(dimethylamino)ethyl]imidazol-2-yl]phenyl]acetamide
CID 82559432
N',N'-dimethyl-N-[2-(2-phenylimidazol-1-yl)ethyl]ethane-1,2-diamine
CID 62564926
3-[2-[2-(5-ethylfuran-2-yl)imidazol-1-yl]ethylsulfanyl]-4-methyl-1,2,4-triazole
CID 56918417
N-[(2-methoxypyrimidin-5-yl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
CID 131900895
5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine
CID 72851312

Frequently Asked Questions

What is the IUPAC name of 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine (CID 166620898) is 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine is CCc1cnc(-c2ccc(-c3nccn3CCN(C)C)o2)nc1.
What is the InChIKey of 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine?
The InChIKey is OXLVYISAELJEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-4-13-11-19-16(20-12-13)14-5-6-15(23-14)17-18-7-8-22(17)10-9-21(2)3/h5-8,11-12H,4,9-10H2,1-3H3.
What are the key properties of 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine?
2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine has a molecular weight of 311.39 g/mol, XLogP of 2.72, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[5-(5-ethylpyrimidin-2-yl)furan-2-yl]imidazol-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 166620898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).