1-deuterio-7-methylindolizine

C9H9N — CID 171478301

IUPAC1-deuterio-7-methylindolizine
SMILES[2H]c1ccn2ccc(C)cc12
InChIInChI=1S/C9H9N/c1-8-4-6-10-5-2-3-9(10)7-8/h2-7H,1H3/i3D
InChIKeyPWPFETRIYNRQCU-WFVSFCRTSA-N
MW132.18 g/mol
LogP2.25
Rot. Bonds

About 1-deuterio-7-methylindolizine

1-deuterio-7-methylindolizine (PubChem CID 171478301) has the molecular formula C9H9N and a molecular weight of 132.18 g/mol. Its IUPAC name is 1-deuterio-7-methylindolizine.

Molecular Properties

Compound Name1-deuterio-7-methylindolizine
PubChem CID171478301
Molecular FormulaC9H9N
Molecular Weight132.18 g/mol
Exact Mass132.08
IUPAC Name1-deuterio-7-methylindolizine
SMILES[2H]c1ccn2ccc(C)cc12
InChIInChI=1S/C9H9N/c1-8-4-6-10-5-2-3-9(10)7-8/h2-7H,1H3/i3D
InChIKeyPWPFETRIYNRQCU-WFVSFCRTSA-N
XLogP2.25
TPSA4.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

indolizine;toluene
CID 175477337
3,7-dimethylindolizine
CID 59539272
7-methyl-2-propan-2-ylindolizine;propane
CID 142104989
phosphane;tris(1,3-xylene)
CID 67351774
3-ethyl-7-methylimidazo[1,5-a]pyridine
CID 117144613
2-methylbenzo[b]quinolizin-6-one
CID 2752779
argon;1,3-xylene
CID 161468194
uranium;1,3-xylene
CID 142096795
ethane;1,3-xylene
CID 54570178
7-methyl-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 117144416
7-methyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine
CID 152667563
3-(2-bromophenyl)-7-methylimidazo[1,5-a]pyridine
CID 117144722

Frequently Asked Questions

What is the IUPAC name of 1-deuterio-7-methylindolizine?
The IUPAC name of 1-deuterio-7-methylindolizine (CID 171478301) is 1-deuterio-7-methylindolizine.
What is the SMILES notation for 1-deuterio-7-methylindolizine?
The canonical SMILES for 1-deuterio-7-methylindolizine is [2H]c1ccn2ccc(C)cc12.
What is the InChIKey of 1-deuterio-7-methylindolizine?
The InChIKey is PWPFETRIYNRQCU-WFVSFCRTSA-N. The full InChI is InChI=1S/C9H9N/c1-8-4-6-10-5-2-3-9(10)7-8/h2-7H,1H3/i3D.
What are the key properties of 1-deuterio-7-methylindolizine?
1-deuterio-7-methylindolizine has a molecular weight of 132.18 g/mol, XLogP of 2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-deuterio-7-methylindolizine is sourced from PubChem (CID 171478301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).