2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine

C14H18N2O2 — CID 11565020

IUPAC2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2c(OCC3CCCO3)nccc2c1C
InChIInChI=1S/C14H18N2O2/c1-9-10(2)16-13-12(9)5-6-15-14(13)18-8-11-4-3-7-17-11/h5-6,11,16H,3-4,7-8H2,1-2H3
InChIKeyUCBJSGIYJXATGZ-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.74
Rot. Bonds3

About 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine

2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine (PubChem CID 11565020) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine
PubChem CID11565020
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine
SMILESCc1[nH]c2c(OCC3CCCO3)nccc2c1C
InChIInChI=1S/C14H18N2O2/c1-9-10(2)16-13-12(9)5-6-15-14(13)18-8-11-4-3-7-17-11/h5-6,11,16H,3-4,7-8H2,1-2H3
InChIKeyUCBJSGIYJXATGZ-UHFFFAOYSA-N
XLogP2.74
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-methyl-2-(oxolan-2-ylmethoxy)pyridine-3-carboxylate
CID 131992608
4-(chloromethyl)-3-fluoro-2-(oxolan-2-ylmethoxy)pyridine
CID 105383749
3-chloro-4,5-dimethyl-6-(oxolan-2-ylmethoxy)pyridazine
CID 63271996
N-methyl-1-(oxolan-2-ylmethoxy)isoquinolin-8-amine
CID 82572504
2-[(2,5-dimethylphenoxy)methyl]oxolane
CID 71627927
(2S)-2-[(2,5-dimethylphenoxy)methyl]oxolane
CID 97170620
N-[[2-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62291426
4-(oxolan-2-ylmethoxy)pyridine-2-carbonitrile
CID 62936750
4-chloro-5-methyl-6-(oxan-2-ylmethoxy)pyrimidine
CID 63736573
N-ethyl-1-[2-(oxolan-2-ylmethoxy)-3-pyridinyl]ethanamine
CID 114056588
7-[(2,3-difluorophenyl)methoxy]-2,3-dimethyl-1H-pyrrolo[2,3-c]pyridine
CID 11594442
2-methyl-4-(oxolan-2-ylmethoxy)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
CID 143219161

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine (CID 11565020) is 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine is Cc1[nH]c2c(OCC3CCCO3)nccc2c1C.
What is the InChIKey of 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine?
The InChIKey is UCBJSGIYJXATGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-9-10(2)16-13-12(9)5-6-15-14(13)18-8-11-4-3-7-17-11/h5-6,11,16H,3-4,7-8H2,1-2H3.
What are the key properties of 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine?
2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine has a molecular weight of 246.31 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-7-(oxolan-2-ylmethoxy)-1H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 11565020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).