1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine

C16H26N4O — CID 79498021

IUPAC1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
SMILESCOc1ccc(CC2(C)CN=C(N)N2CCN(C)C)cc1
InChIInChI=1S/C16H26N4O/c1-16(11-13-5-7-14(21-4)8-6-13)12-18-15(17)20(16)10-9-19(2)3/h5-8H,9-12H2,1-4H3,(H2,17,18)
InChIKeyIPHIQNOVXPPGEB-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.19
Rot. Bonds6

About 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine

1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine (PubChem CID 79498021) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
PubChem CID79498021
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine
SMILESCOc1ccc(CC2(C)CN=C(N)N2CCN(C)C)cc1
InChIInChI=1S/C16H26N4O/c1-16(11-13-5-7-14(21-4)8-6-13)12-18-15(17)20(16)10-9-19(2)3/h5-8H,9-12H2,1-4H3,(H2,17,18)
InChIKeyIPHIQNOVXPPGEB-UHFFFAOYSA-N
XLogP1.19
TPSA54.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(4-methoxyphenyl)methyl]-5-methyl-1-propyl-4H-imidazol-2-amine
CID 79509403
5-benzyl-1-[2-(dimethylamino)ethyl]-5-methyl-4H-imidazol-2-amine
CID 79498194
5-(4-methoxyphenyl)-5-methyl-1-propyl-4H-imidazol-2-amine
CID 79510183
5-benzyl-1-ethyl-5-methyl-4H-imidazol-2-amine
CID 79510395
5-benzyl-1-[2-(dimethylamino)ethyl]-5-ethyl-4H-imidazol-2-amine
CID 79496547
4-[2-amino-1-[2-(dimethylamino)ethyl]-5-methyl-4H-imidazol-5-yl]phenol
CID 79496558
2-[(4-methoxyphenyl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 71756717
5-[(2-methoxyphenyl)methyl]-5-methyl-1-(2-methylpropyl)-4H-imidazol-2-amine
CID 79498859
1-benzyl-5-(methoxymethyl)-5-methyl-4H-imidazol-2-amine
CID 79505944
1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride
CID 75361270
1-(cyclopropylmethyl)-5-ethyl-5-(4-methoxyphenyl)-4H-imidazol-2-amine
CID 79520804
5-ethyl-5-(4-methoxyphenyl)-1-prop-2-enyl-4H-imidazol-2-amine
CID 79497656

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine (CID 79498021) is 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine is COc1ccc(CC2(C)CN=C(N)N2CCN(C)C)cc1.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine?
The InChIKey is IPHIQNOVXPPGEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-16(11-13-5-7-14(21-4)8-6-13)12-18-15(17)20(16)10-9-19(2)3/h5-8H,9-12H2,1-4H3,(H2,17,18).
What are the key properties of 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine?
1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine has a molecular weight of 290.41 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-5-[(4-methoxyphenyl)methyl]-5-methyl-4H-imidazol-2-amine is sourced from PubChem (CID 79498021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).