N,N,1-trimethyl-4,5-dihydroimidazol-2-amine

C6H13N3 — CID 21134150

IUPACN,N,1-trimethyl-4,5-dihydroimidazol-2-amine
SMILESCN(C)C1=NCCN1C
InChIInChI=1S/C6H13N3/c1-8(2)6-7-4-5-9(6)3/h4-5H2,1-3H3
InChIKeyIMPGHQNQQIBFOI-UHFFFAOYSA-N
MW127.19 g/mol
LogP-0.15
Rot. Bonds

About N,N,1-trimethyl-4,5-dihydroimidazol-2-amine

N,N,1-trimethyl-4,5-dihydroimidazol-2-amine (PubChem CID 21134150) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is N,N,1-trimethyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN,N,1-trimethyl-4,5-dihydroimidazol-2-amine
PubChem CID21134150
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC NameN,N,1-trimethyl-4,5-dihydroimidazol-2-amine
SMILESCN(C)C1=NCCN1C
InChIInChI=1S/C6H13N3/c1-8(2)6-7-4-5-9(6)3/h4-5H2,1-3H3
InChIKeyIMPGHQNQQIBFOI-UHFFFAOYSA-N
XLogP-0.15
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 5-0.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N,N,1-trimethyl-4,5-dihydroimidazol-2-amine (CID 21134150) is N,N,1-trimethyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N,N,1-trimethyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N,N,1-trimethyl-4,5-dihydroimidazol-2-amine is CN(C)C1=NCCN1C.
What is the InChIKey of N,N,1-trimethyl-4,5-dihydroimidazol-2-amine?
The InChIKey is IMPGHQNQQIBFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c1-8(2)6-7-4-5-9(6)3/h4-5H2,1-3H3.
What are the key properties of N,N,1-trimethyl-4,5-dihydroimidazol-2-amine?
N,N,1-trimethyl-4,5-dihydroimidazol-2-amine has a molecular weight of 127.19 g/mol, XLogP of -0.15, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 21134150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).