N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine

C11H17N5 — CID 106568451

IUPACN,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
SMILESCNc1nc(C)cn1CCc1nccn1C
InChIInChI=1S/C11H17N5/c1-9-8-16(11(12-2)14-9)6-4-10-13-5-7-15(10)3/h5,7-8H,4,6H2,1-3H3,(H,12,14)
InChIKeyPHENINKULVGZPK-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.21
Rot. Bonds4

About N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine

N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine (PubChem CID 106568451) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
PubChem CID106568451
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
SMILESCNc1nc(C)cn1CCc1nccn1C
InChIInChI=1S/C11H17N5/c1-9-8-16(11(12-2)14-9)6-4-10-13-5-7-15(10)3/h5,7-8H,4,6H2,1-3H3,(H,12,14)
InChIKeyPHENINKULVGZPK-UHFFFAOYSA-N
XLogP1.21
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]imidazole
CID 114531881
N,4-dimethyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571785
1-[2-(3,5-difluorophenyl)ethyl]-N,4-dimethylimidazol-2-amine
CID 106570292
1-hexyl-N,4-dimethylimidazol-2-amine
CID 106573791
1-[2-(2-fluorophenyl)ethyl]-N,4-dimethylimidazol-2-amine
CID 106557413
[1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-yl]methanamine
CID 114528906
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
CID 106568458
1-[2-(3,4-dimethoxyphenyl)ethyl]-N,4-dimethylimidazol-2-amine
CID 106555784
N-(3-methoxypropyl)-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
CID 106568485
1-methyl-2-[2-(3-methylpyrazol-1-yl)ethyl]imidazole
CID 114531887
N-methyl-1-[3-[2-(1-methylimidazol-2-yl)ethyl]imidazol-4-yl]methanamine
CID 66151369

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine (CID 106568451) is N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine is CNc1nc(C)cn1CCc1nccn1C.
What is the InChIKey of N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The InChIKey is PHENINKULVGZPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-9-8-16(11(12-2)14-9)6-4-10-13-5-7-15(10)3/h5,7-8H,4,6H2,1-3H3,(H,12,14).
What are the key properties of N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine has a molecular weight of 219.29 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106568451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).