4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine

C5H10N2Se — CID 72819457

IUPAC4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine
SMILESCC1N=C(N)[Se]C1C
InChIInChI=1S/C5H10N2Se/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)
InChIKeyDPBBICQHJYABGP-UHFFFAOYSA-N
MW177.11 g/mol
LogP0.22
Rot. Bonds

About 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine

4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine (PubChem CID 72819457) has the molecular formula C5H10N2Se and a molecular weight of 177.11 g/mol. Its IUPAC name is 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine
PubChem CID72819457
Molecular FormulaC5H10N2Se
Molecular Weight177.11 g/mol
Exact Mass178.00
IUPAC Name4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine
SMILESCC1N=C(N)[Se]C1C
InChIInChI=1S/C5H10N2Se/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)
InChIKeyDPBBICQHJYABGP-UHFFFAOYSA-N
XLogP0.22
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.11
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-(2-amino-4-methyl-4,5-dihydro-1,3-thiazol-5-yl)ethanone
CID 10261355
(2S,3R)-2,3-dimethyl-2,3-dihydropyrazino[2,3-b]pyrazine
CID 59200625
3-methyl-3,6-dihydro-2H-1,4-thiazin-5-amine
CID 45078881
2-methyl-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 12778911
4-ethyl-4,5-dihydro-1,3-selenazol-2-amine
CID 72770334
2-methyl-3,4,5,6-tetrahydro-2H-azepin-7-amine;hydrochloride
CID 12778912
ethyl (4R,5R)-2-amino-4-methyl-4,5-dihydro-1,3-thiazole-5-carboxylate
CID 93488827
5-methyl-2,5,6,7-tetrahydro-1H-1,4-diazepin-3-amine;dihydrochloride
CID 67761525
2,4,5-trimethyl-4,5-dihydropyrimidine
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1,4-dimethyl-4,5-dihydroimidazol-2-amine
CID 154143742
2,3,5,6-tetramethyl-2,3-dihydropyridine
CID 123760837
ethane;2,3,6-trimethyl-2,3-dihydropyridine
CID 144863717

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine?
The IUPAC name of 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine (CID 72819457) is 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine.
What is the SMILES notation for 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine?
The canonical SMILES for 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine is CC1N=C(N)[Se]C1C.
What is the InChIKey of 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine?
The InChIKey is DPBBICQHJYABGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2Se/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7).
What are the key properties of 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine?
4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine has a molecular weight of 177.11 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-4,5-dihydro-1,3-selenazol-2-amine is sourced from PubChem (CID 72819457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).