5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine

C18H27N3O2 — CID 3339952

IUPAC5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCCOc1ccc(-c2cnc(NCC(C)C)n2CCOC)cc1
InChIInChI=1S/C18H27N3O2/c1-5-23-16-8-6-15(7-9-16)17-13-20-18(19-12-14(2)3)21(17)10-11-22-4/h6-9,13-14H,5,10-12H2,1-4H3,(H,19,20)
InChIKeyXWEGAEMIQBTHPK-UHFFFAOYSA-N
MW317.43 g/mol
LogP3.66
Rot. Bonds9

About 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine

5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 3339952) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine
PubChem CID3339952
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCCOc1ccc(-c2cnc(NCC(C)C)n2CCOC)cc1
InChIInChI=1S/C18H27N3O2/c1-5-23-16-8-6-15(7-9-16)17-13-20-18(19-12-14(2)3)21(17)10-11-22-4/h6-9,13-14H,5,10-12H2,1-4H3,(H,19,20)
InChIKeyXWEGAEMIQBTHPK-UHFFFAOYSA-N
XLogP3.66
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[[5-(4-ethoxyphenyl)-1-(2-methylbutyl)imidazol-2-yl]amino]methyl]-2,6-dimethoxyphenol
CID 45147032
5-(4-chlorophenyl)-1-(2-methoxyethyl)-N-[(2,3,4-trimethoxyphenyl)methyl]imidazol-2-amine
CID 3884020
5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
CID 4539990
5-(4-chlorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
CID 4691572
N-[(2,3-dichlorophenyl)methyl]-5-(4-fluorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 4034868
N-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 5042199
4-[[[5-(4-fluorophenyl)-1-(2-methoxyethyl)imidazol-2-yl]amino]methyl]-2-methoxyphenol
CID 3284600
N-[(2-chloro-6-fluorophenyl)methyl]-5-(4-ethoxyphenyl)-1-(2-methylbutyl)imidazol-2-amine
CID 51362459
N-[5-(4-ethoxyphenyl)-1-methylimidazol-2-yl]propanamide
CID 3917768
1-(2,3-dimethylphenyl)-3-[1-(2-methoxyethyl)-5-(4-methoxyphenyl)imidazol-2-yl]urea
CID 22577946
1-butyl-N-[(3-chlorophenyl)methyl]-5-(4-ethoxyphenyl)imidazol-2-amine;oxalic acid
CID 146051200
4-chloro-2-[[[1-(2-methoxyethyl)-5-phenylimidazol-2-yl]amino]methyl]phenol;oxalic acid
CID 163327011

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine (CID 3339952) is 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine is CCOc1ccc(-c2cnc(NCC(C)C)n2CCOC)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is XWEGAEMIQBTHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-5-23-16-8-6-15(7-9-16)17-13-20-18(19-12-14(2)3)21(17)10-11-22-4/h6-9,13-14H,5,10-12H2,1-4H3,(H,19,20).
What are the key properties of 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine?
5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 317.43 g/mol, XLogP of 3.66, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 3339952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).