1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine

C6H11N3 — CID 11457689

IUPAC1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1ncc[nH]1
InChIInChI=1S/C6H11N3/c1-9(2)5-6-7-3-4-8-6/h3-4H,5H2,1-2H3,(H,7,8)
InChIKeySJAACDLJWHJJFO-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.47
Rot. Bonds2

About 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine

1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine (PubChem CID 11457689) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine
PubChem CID11457689
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1ncc[nH]1
InChIInChI=1S/C6H11N3/c1-9(2)5-6-7-3-4-8-6/h3-4H,5H2,1-2H3,(H,7,8)
InChIKeySJAACDLJWHJJFO-UHFFFAOYSA-N
XLogP0.47
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine (CID 11457689) is 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine is CN(C)Cc1ncc[nH]1.
What is the InChIKey of 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The InChIKey is SJAACDLJWHJJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-9(2)5-6-7-3-4-8-6/h3-4H,5H2,1-2H3,(H,7,8).
What are the key properties of 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine?
1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine has a molecular weight of 125.17 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 11457689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).