1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine

C5H12N4 — CID 169197474

IUPAC1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine
SMILESCNNCC1=NCCN1
InChIInChI=1S/C5H12N4/c1-6-9-4-5-7-2-3-8-5/h6,9H,2-4H2,1H3,(H,7,8)
InChIKeyHRQHVXFHTDNQFO-UHFFFAOYSA-N
MW128.18 g/mol
LogP-1.29
Rot. Bonds3

About 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine

1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine (PubChem CID 169197474) has the molecular formula C5H12N4 and a molecular weight of 128.18 g/mol. Its IUPAC name is 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine.

Molecular Properties

Compound Name1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine
PubChem CID169197474
Molecular FormulaC5H12N4
Molecular Weight128.18 g/mol
Exact Mass128.11
IUPAC Name1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine
SMILESCNNCC1=NCCN1
InChIInChI=1S/C5H12N4/c1-6-9-4-5-7-2-3-8-5/h6,9H,2-4H2,1H3,(H,7,8)
InChIKeyHRQHVXFHTDNQFO-UHFFFAOYSA-N
XLogP-1.29
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 5-1.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine?
The IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine (CID 169197474) is 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine.
What is the SMILES notation for 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine?
The canonical SMILES for 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine is CNNCC1=NCCN1.
What is the InChIKey of 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine?
The InChIKey is HRQHVXFHTDNQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N4/c1-6-9-4-5-7-2-3-8-5/h6,9H,2-4H2,1H3,(H,7,8).
What are the key properties of 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine?
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine has a molecular weight of 128.18 g/mol, XLogP of -1.29, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methylhydrazine is sourced from PubChem (CID 169197474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).