5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine

C18H22N4 — CID 143015233

IUPAC5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine
SMILESCCc1nc(N(C)C)ccc1-c1nc2c(C)c[nH]c2cc1C
InChIInChI=1S/C18H22N4/c1-6-14-13(7-8-16(20-14)22(4)5)17-11(2)9-15-18(21-17)12(3)10-19-15/h7-10,19H,6H2,1-5H3
InChIKeyTZRHTZSDSMTKGV-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.87
Rot. Bonds3

About 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine

5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine (PubChem CID 143015233) has the molecular formula C18H22N4 and a molecular weight of 294.40 g/mol. Its IUPAC name is 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine
PubChem CID143015233
Molecular FormulaC18H22N4
Molecular Weight294.40 g/mol
Exact Mass294.18
IUPAC Name5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine
SMILESCCc1nc(N(C)C)ccc1-c1nc2c(C)c[nH]c2cc1C
InChIInChI=1S/C18H22N4/c1-6-14-13(7-8-16(20-14)22(4)5)17-11(2)9-15-18(21-17)12(3)10-19-15/h7-10,19H,6H2,1-5H3
InChIKeyTZRHTZSDSMTKGV-UHFFFAOYSA-N
XLogP3.87
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine with MolForge

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Related Compounds

5-(6-ethoxy-2-ethyl-3-pyridinyl)-3,6-dimethyl-1H-pyrrolo[3,2-b]pyridine;pentan-1-ol
CID 143580486
butane;2-(6-ethoxy-2-ethyl-3-pyridinyl)-3,7-dimethyl-5H-pyrrolo[2,3-b]pyrazine
CID 143580290
5-[6-(dimethylamino)-2-ethyl-3-pyridinyl]-6-methyl-3-methylsulfanyl-N-pentan-3-ylpyrazin-2-amine
CID 58804411
3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane
CID 144820313
5-(2,6-diethyl-3-pyridinyl)-3,6-dimethyl-1-propan-2-ylpyrrolo[3,2-b]pyridine
CID 58703043
9-[4-[9-(dimethylamino)-1,10-phenanthrolin-2-yl]-2,5-dimethylphenyl]-N,N-dimethyl-1,10-phenanthrolin-2-amine
CID 59736535
6-ethyl-2-N,2-N,5-trimethylpyridine-2,4-diamine
CID 910041
ethane;methoxyethane;6-methoxy-5-(2-methoxy-6-propan-2-yl-3-pyridinyl)-3-methyl-1H-pyrrolo[3,2-b]pyridine
CID 143014938
5-(2-ethyl-6-methoxy-3-pyridinyl)-3,6-dimethyl-1-propan-2-ylpyrrolo[3,2-b]pyridine
CID 58702800
6-chloro-3-methyl-5-(2-methyl-6-propan-2-yl-3-pyridinyl)-1H-pyrrolo[3,2-b]pyridine;fluoroethane;methoxyethane
CID 143015242
6-methoxy-5-(2-methoxy-6-propan-2-yl-3-pyridinyl)-3-methyl-1H-pyrrolo[3,2-b]pyridine
CID 143014939
4-ethyl-7-methyl-5H-pyrrolo[3,2-d]pyrimidine
CID 123540887

Frequently Asked Questions

What is the IUPAC name of 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine (CID 143015233) is 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine is CCc1nc(N(C)C)ccc1-c1nc2c(C)c[nH]c2cc1C.
What is the InChIKey of 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine?
The InChIKey is TZRHTZSDSMTKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4/c1-6-14-13(7-8-16(20-14)22(4)5)17-11(2)9-15-18(21-17)12(3)10-19-15/h7-10,19H,6H2,1-5H3.
What are the key properties of 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine?
5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine has a molecular weight of 294.40 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 143015233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).