(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole

C5H10N2 — CID 7015316

IUPAC(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole
SMILESCC1=NC[C@H](C)N1
InChIInChI=1S/C5H10N2/c1-4-3-6-5(2)7-4/h4H,3H2,1-2H3,(H,6,7)/t4-/m0/s1
InChIKeyDIHAURBCYGTGCV-BYPYZUCNSA-N
MW98.15 g/mol
LogP0.40
Rot. Bonds

About (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole

(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole (PubChem CID 7015316) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole
PubChem CID7015316
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole
SMILESCC1=NC[C@H](C)N1
InChIInChI=1S/C5H10N2/c1-4-3-6-5(2)7-4/h4H,3H2,1-2H3,(H,6,7)/t4-/m0/s1
InChIKeyDIHAURBCYGTGCV-BYPYZUCNSA-N
XLogP0.40
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole?
The IUPAC name of (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole (CID 7015316) is (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole is CC1=NC[C@H](C)N1.
What is the InChIKey of (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole?
The InChIKey is DIHAURBCYGTGCV-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H10N2/c1-4-3-6-5(2)7-4/h4H,3H2,1-2H3,(H,6,7)/t4-/m0/s1.
What are the key properties of (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole?
(5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole has a molecular weight of 98.15 g/mol, XLogP of 0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-2,5-dimethyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 7015316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).