ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine

C15H28N2 — CID 142502907

IUPACethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
SMILESCC.CCC.Cc1nc(C)c2c(c1C)CNC2
InChIInChI=1S/C10H14N2.C3H8.C2H6/c1-6-7(2)12-8(3)10-5-11-4-9(6)10;1-3-2;1-2/h11H,4-5H2,1-3H3;3H2,1-2H3;1-2H3
InChIKeyHCYXOYSHKSLLGV-UHFFFAOYSA-N
MW236.40 g/mol
LogP4.05
Rot. Bonds

About ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine

ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine (PubChem CID 142502907) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine.

Molecular Properties

Compound Nameethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
PubChem CID142502907
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Nameethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
SMILESCC.CCC.Cc1nc(C)c2c(c1C)CNC2
InChIInChI=1S/C10H14N2.C3H8.C2H6/c1-6-7(2)12-8(3)10-5-11-4-9(6)10;1-3-2;1-2/h11H,4-5H2,1-3H3;3H2,1-2H3;1-2H3
InChIKeyHCYXOYSHKSLLGV-UHFFFAOYSA-N
XLogP4.05
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1,3,4-trimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 169136046
2,3,4-trimethyl-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 20689236
4-methyl-2-(2-methylpropyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740210
1,3-dimethyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
CID 177024453
8-methyl-4,5,7,11-tetrazatricyclo[7.3.0.02,6]dodeca-1,3,6,8-tetraene
CID 96630461
4-ethyl-2-methyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 83845774
2-methyl-4-propyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740981
5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one
CID 151318248
4,5,6,7,8,9,10-heptamethyl-2,3-dihydro-1H-pyrrolo[3,4-b]carbazole
CID 58773403
2-(3-methoxypropyl)-4-methyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740001
2-[(3,5-dimethylphenyl)methyl]-4-methyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740025
2-(2-methoxypropyl)-4-methyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740071

Frequently Asked Questions

What is the IUPAC name of ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine?
The IUPAC name of ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine (CID 142502907) is ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine.
What is the SMILES notation for ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine?
The canonical SMILES for ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine is CC.CCC.Cc1nc(C)c2c(c1C)CNC2.
What is the InChIKey of ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine?
The InChIKey is HCYXOYSHKSLLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.C3H8.C2H6/c1-6-7(2)12-8(3)10-5-11-4-9(6)10;1-3-2;1-2/h11H,4-5H2,1-3H3;3H2,1-2H3;1-2H3.
What are the key properties of ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine?
ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine has a molecular weight of 236.40 g/mol, XLogP of 4.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;propane;4,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine is sourced from PubChem (CID 142502907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).