1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine

C13H25N3O — CID 79521417

IUPAC1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine
SMILESCOC(C)(C)CC1(C)CN=C(N)N1CC1CC1
InChIInChI=1S/C13H25N3O/c1-12(2,17-4)8-13(3)9-15-11(14)16(13)7-10-5-6-10/h10H,5-9H2,1-4H3,(H2,14,15)
InChIKeyAJVLNMFXISTMAL-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.60
Rot. Bonds5

About 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine

1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine (PubChem CID 79521417) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine
PubChem CID79521417
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine
SMILESCOC(C)(C)CC1(C)CN=C(N)N1CC1CC1
InChIInChI=1S/C13H25N3O/c1-12(2,17-4)8-13(3)9-15-11(14)16(13)7-10-5-6-10/h10H,5-9H2,1-4H3,(H2,14,15)
InChIKeyAJVLNMFXISTMAL-UHFFFAOYSA-N
XLogP1.60
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methoxy-2-methylpropyl)-5-methyl-1-propyl-4H-imidazol-2-amine
CID 79509860
1-(cyclopropylmethyl)-5-[(2-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
CID 79521409
5-(2-methoxy-2-methylpropyl)-5-methyl-1-phenyl-4H-imidazol-2-amine
CID 79514376
5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine
CID 79501421
1-(cyclopropylmethyl)-5-(2-methoxy-5-methylphenyl)-5-methyl-4H-imidazol-2-amine
CID 79521330
1-(cyclopropylmethyl)-5-ethyl-5-(4-methoxyphenyl)-4H-imidazol-2-amine
CID 79520804
1-(cyclopropylmethyl)-5-methyl-5-pyridin-3-yl-4H-imidazol-2-amine
CID 79521666
1-(cyclopropylmethyl)-5-ethyl-5-(2-methylbutyl)-4H-imidazol-2-amine
CID 79521413
5-(methoxymethyl)-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
CID 79497499
5-(5-bromo-2-fluorophenyl)-1-(cyclopropylmethyl)-5-methyl-4H-imidazol-2-amine
CID 82973144
5-(3-chloro-4-fluorophenyl)-1-(cyclopropylmethyl)-5-methyl-4H-imidazol-2-amine
CID 79520713
1-ethyl-5-methyl-5-(4,4,4-trifluorobutyl)-4H-imidazol-2-amine
CID 116536433

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine?
The IUPAC name of 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine (CID 79521417) is 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine is COC(C)(C)CC1(C)CN=C(N)N1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine?
The InChIKey is AJVLNMFXISTMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-12(2,17-4)8-13(3)9-15-11(14)16(13)7-10-5-6-10/h10H,5-9H2,1-4H3,(H2,14,15).
What are the key properties of 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine?
1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine has a molecular weight of 239.36 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-5-(2-methoxy-2-methylpropyl)-5-methyl-4H-imidazol-2-amine is sourced from PubChem (CID 79521417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).