5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine

C7H14N4 — CID 24696807

IUPAC5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine
SMILESCN(C)c1ncc(CN)n1C
InChIInChI=1S/C7H14N4/c1-10(2)7-9-5-6(4-8)11(7)3/h5H,4,8H2,1-3H3
InChIKeySZHQGRXHKRQMLH-UHFFFAOYSA-N
MW154.22 g/mol
LogP-0.06
Rot. Bonds2

About 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine

5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine (PubChem CID 24696807) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine
PubChem CID24696807
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine
SMILESCN(C)c1ncc(CN)n1C
InChIInChI=1S/C7H14N4/c1-10(2)7-9-5-6(4-8)11(7)3/h5H,4,8H2,1-3H3
InChIKeySZHQGRXHKRQMLH-UHFFFAOYSA-N
XLogP-0.06
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 13195
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3-Methylhistamine
CID 69520
1,5-Dimethylimidazole
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1,4-Dimethylimidazole
CID 138733
1-Methylhistamine dihydrochloride
CID 11957601
1H-Imidazole-1-propanenitrile, 2-ethyl-4-methyl-
CID 90327
N-ethylhistamine
CID 44292270
2-(1-Methyl-1H-imidazol-4-yl)ethanamine hydrochloride
CID 16219661
2-(1-Isopropyl-1H-imidazol-4-yl)ethanamine
CID 585835
5-methyl-1H-imidazol-2-amine
CID 322559
1-Methyl-1H-imidazole-4-carbonitrile
CID 2795115

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine?
The IUPAC name of 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine (CID 24696807) is 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine?
The canonical SMILES for 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine is CN(C)c1ncc(CN)n1C.
What is the InChIKey of 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine?
The InChIKey is SZHQGRXHKRQMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-10(2)7-9-5-6(4-8)11(7)3/h5H,4,8H2,1-3H3.
What are the key properties of 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine?
5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine has a molecular weight of 154.22 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N,N,1-trimethylimidazol-2-amine is sourced from PubChem (CID 24696807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).