2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine

C13H18N2 — CID 68810894

IUPAC2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine
SMILESCc1c(C)n(CC(C)C)c2cnccc12
InChIInChI=1S/C13H18N2/c1-9(2)8-15-11(4)10(3)12-5-6-14-7-13(12)15/h5-7,9H,8H2,1-4H3
InChIKeyBRBMHKTXHMZFME-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.31
Rot. Bonds2

About 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine

2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine (PubChem CID 68810894) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine
PubChem CID68810894
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine
SMILESCc1c(C)n(CC(C)C)c2cnccc12
InChIInChI=1S/C13H18N2/c1-9(2)8-15-11(4)10(3)12-5-6-14-7-13(12)15/h5-7,9H,8H2,1-4H3
InChIKeyBRBMHKTXHMZFME-UHFFFAOYSA-N
XLogP3.31
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethyl-1-(3-methylbut-2-enyl)pyrrolo[2,3-c]pyridine;hydrochloride
CID 68813353
1-chloro-2,3-dimethylpyrrolo[2,3-c]pyridine
CID 141136088
5-(3-isocyanophenyl)-2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine
CID 140813436
1,3-dimethylpyrrolo[2,3-c]pyridine
CID 59430828
5,6-dimethyl-2,8-phenanthroline
CID 139435789
3-(2-methylpropyl)-2-[(3R)-pyrrolidin-3-yl]imidazo[4,5-c]pyridine
CID 97032975
(3E,5E,8Z,9Z,12E,14Z,17Z)-17-[(Z)-3-(2,3-dimethylpyrrolo[2,3-c]pyridin-1-yl)prop-1-enyl]-15-ethenyl-6-ethyl-8-ethylidene-N-methylicosa-1,3,5,9,12,14,17,19-octaen-3-amine
CID 142955102
N-methyl-4-[4-(2-methylpropyl)-3-oxopyrido[3,4-b]pyrazin-2-yl]piperazine-1-carboxamide
CID 53194749
2,3-dimethyl-1-(3-methylbutyl)-7-(4-methylphenyl)pyrrolo[2,3-c]pyridine
CID 67141608
[5-[1-(2-methylpropyl)imidazo[4,5-c]pyridin-2-yl]furan-2-yl]phosphonic acid
CID 25029959
3-(2-methylpropyl)-2-pyridin-3-ylimidazo[4,5-b]pyridine
CID 117164742
2,7-dimethyl-9-(2-methylpropyl)carbazole
CID 130182520

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine?
The IUPAC name of 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine (CID 68810894) is 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine is Cc1c(C)n(CC(C)C)c2cnccc12.
What is the InChIKey of 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine?
The InChIKey is BRBMHKTXHMZFME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-9(2)8-15-11(4)10(3)12-5-6-14-7-13(12)15/h5-7,9H,8H2,1-4H3.
What are the key properties of 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine?
2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine has a molecular weight of 202.30 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 68810894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).