1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine

C16H25N3O2 — CID 79503022

IUPAC1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine
SMILESCCC(C)N1C(N)=NCC1(C)c1cc(OC)ccc1OC
InChIInChI=1S/C16H25N3O2/c1-6-11(2)19-15(17)18-10-16(19,3)13-9-12(20-4)7-8-14(13)21-5/h7-9,11H,6,10H2,1-5H3,(H2,17,18)
InChIKeyLFLAHCXGLRJTTJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.35
Rot. Bonds5

About 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine

1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine (PubChem CID 79503022) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine
PubChem CID79503022
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine
SMILESCCC(C)N1C(N)=NCC1(C)c1cc(OC)ccc1OC
InChIInChI=1S/C16H25N3O2/c1-6-11(2)19-15(17)18-10-16(19,3)13-9-12(20-4)7-8-14(13)21-5/h7-9,11H,6,10H2,1-5H3,(H2,17,18)
InChIKeyLFLAHCXGLRJTTJ-UHFFFAOYSA-N
XLogP2.35
TPSA60.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopropyl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine
CID 79509754
1-butan-2-yl-5-(4-ethoxyphenyl)-5-methyl-4H-imidazol-2-amine
CID 79514284
1-butan-2-yl-5-(2,5-dimethylphenyl)-5-methyl-4H-imidazol-2-amine
CID 79513993
7-methoxy-1'-(2-methylpropyl)spiro[2,3-dihydro-1H-naphthalene-4,5'-4H-imidazole]-2'-amine
CID 79498420
1-(cyclopropylmethyl)-5-(2-methoxy-5-methylphenyl)-5-methyl-4H-imidazol-2-amine
CID 79521330
1-butan-2-yl-5-ethyl-5-(methoxymethyl)-4H-imidazol-2-amine
CID 79505096
5-methoxy-1'-prop-2-enylspiro[1,2-dihydroindene-3,5'-4H-imidazole]-2'-amine
CID 79498722
1-butan-2-yl-7,7,9,9-tetramethyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 103961626
5-amino-1-butan-2-yl-6-(2,5-dimethoxyphenyl)piperidin-2-one
CID 82193380
1'-butan-2-ylspiro[1,3-dihydroindene-2,5'-4H-imidazole]-2'-amine
CID 79514665
1-butan-2-yl-6-methoxy-2,3-dihydroindole
CID 134369277
2-(2,5-dimethoxyphenyl)-2-methyl-4-oxoazetidine-1-sulfonyl chloride
CID 64667055

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The IUPAC name of 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine (CID 79503022) is 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The canonical SMILES for 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine is CCC(C)N1C(N)=NCC1(C)c1cc(OC)ccc1OC.
What is the InChIKey of 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The InChIKey is LFLAHCXGLRJTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-6-11(2)19-15(17)18-10-16(19,3)13-9-12(20-4)7-8-14(13)21-5/h7-9,11H,6,10H2,1-5H3,(H2,17,18).
What are the key properties of 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine?
1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine has a molecular weight of 291.40 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-5-(2,5-dimethoxyphenyl)-5-methyl-4H-imidazol-2-amine is sourced from PubChem (CID 79503022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).