(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole

C10H16N2 — CID 147410620

IUPAC(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole
SMILESCC1C=N[C@@H]1C1=CN[C@H](C)[C@@H]1C
InChIInChI=1S/C10H16N2/c1-6-4-12-10(6)9-5-11-8(3)7(9)2/h4-8,10-11H,1-3H3/t6?,7-,8+,10-/m0/s1
InChIKeyDQNMEBIDISIYFI-UOGQDSSISA-N
MW164.25 g/mol
LogP1.59
Rot. Bonds1

About (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole

(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole (PubChem CID 147410620) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole.

Molecular Properties

Compound Name(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole
PubChem CID147410620
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole
SMILESCC1C=N[C@@H]1C1=CN[C@H](C)[C@@H]1C
InChIInChI=1S/C10H16N2/c1-6-4-12-10(6)9-5-11-8(3)7(9)2/h4-8,10-11H,1-3H3/t6?,7-,8+,10-/m0/s1
InChIKeyDQNMEBIDISIYFI-UOGQDSSISA-N
XLogP1.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole?
The IUPAC name of (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole (CID 147410620) is (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole.
What is the SMILES notation for (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole?
The canonical SMILES for (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole is CC1C=N[C@@H]1C1=CN[C@H](C)[C@@H]1C.
What is the InChIKey of (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole?
The InChIKey is DQNMEBIDISIYFI-UOGQDSSISA-N. The full InChI is InChI=1S/C10H16N2/c1-6-4-12-10(6)9-5-11-8(3)7(9)2/h4-8,10-11H,1-3H3/t6?,7-,8+,10-/m0/s1.
What are the key properties of (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole?
(2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole has a molecular weight of 164.25 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-dimethyl-4-[(2S)-3-methyl-2,3-dihydroazet-2-yl]-2,3-dihydro-1H-pyrrole is sourced from PubChem (CID 147410620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).