3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine

C20H27N5 — CID 143015005

IUPAC3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine
SMILESCCc1c(C)n(C)c2nc(-c3ccc(C(C)C)nc3NC)c(C)nc12
InChIInChI=1S/C20H27N5/c1-8-14-13(5)25(7)20-18(14)22-12(4)17(24-20)15-9-10-16(11(2)3)23-19(15)21-6/h9-11H,8H2,1-7H3,(H,21,23)
InChIKeyPKTBREYIOFYYRR-UHFFFAOYSA-N
MW337.47 g/mol
LogP4.37
Rot. Bonds4

About 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine

3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine (PubChem CID 143015005) has the molecular formula C20H27N5 and a molecular weight of 337.47 g/mol. Its IUPAC name is 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine
PubChem CID143015005
Molecular FormulaC20H27N5
Molecular Weight337.47 g/mol
Exact Mass337.23
IUPAC Name3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine
SMILESCCc1c(C)n(C)c2nc(-c3ccc(C(C)C)nc3NC)c(C)nc12
InChIInChI=1S/C20H27N5/c1-8-14-13(5)25(7)20-18(14)22-12(4)17(24-20)15-9-10-16(11(2)3)23-19(15)21-6/h9-11H,8H2,1-7H3,(H,21,23)
InChIKeyPKTBREYIOFYYRR-UHFFFAOYSA-N
XLogP4.37
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-[2-ethyl-5-methyl-3-[2-(methylamino)-6-propan-2-yl-3-pyridinyl]pyrrolo[2,3-b]pyrazin-7-yl]butan-1-ol
CID 24788523
3,6-diethyl-5-[2-(methylamino)-6-propan-2-yl-3-pyridinyl]-N-pentan-3-ylpyrazin-2-amine
CID 58804525
(2S)-2-[2-ethyl-5-methyl-3-[2-(methylamino)-6-propan-2-yl-3-pyridinyl]pyrrolo[2,3-b]pyrazin-7-yl]pentan-1-ol
CID 69405635
(3R)-3-[3-(2-ethyl-6-propan-2-yl-3-pyridinyl)-2,5-dimethylpyrrolo[2,3-b]pyrazin-7-yl]butan-1-ol
CID 24788873
3-[1-[(2R)-1-methoxybutan-2-yl]-3,6-dimethylpyrrolo[3,2-b]pyridin-5-yl]-N-methyl-6-propan-2-ylpyridin-2-amine
CID 58703019
3-[1-(1-methoxybutan-2-yl)-3,6-dimethylpyrrolo[3,2-b]pyridin-5-yl]-N-methyl-6-propan-2-ylpyridin-2-amine
CID 69447678
N,6-dimethyl-5-(2-methyl-6-propan-2-yl-3-pyridinyl)-3-prop-1-en-2-ylpyrazin-2-amine;methanol;propane
CID 143580324
3-[6-ethyl-1-[(2S)-1-methoxypropan-2-yl]-3-methylpyrrolo[3,2-b]pyridin-5-yl]-N-methyl-6-propan-2-ylpyridin-2-amine
CID 58702767
(Z,3S)-3-ethyl-4-[5-ethyl-2-methyl-6-[2-(methylamino)-6-propan-2-yl-3-pyridinyl]-3-pyridinyl]hex-4-en-1-ol
CID 71157814
2-[[6-ethyl-5-[2-(methylamino)-6-propan-2-yl-3-pyridinyl]-3-prop-1-en-2-ylpyrazin-2-yl]amino]butan-1-ol
CID 143580327
3-[1-[(2S)-1-fluoro-3-methoxypropan-2-yl]-3,6-dimethylpyrrolo[3,2-b]pyridin-5-yl]-N-methyl-6-propan-2-ylpyridin-2-amine
CID 58702905
(2S)-2-[2-(2-methoxy-6-propan-2-yl-3-pyridinyl)-3,7-dimethylpyrrolo[2,3-b]pyrazin-5-yl]-N-methylbutan-1-amine
CID 58702908

Frequently Asked Questions

What is the IUPAC name of 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine?
The IUPAC name of 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine (CID 143015005) is 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine?
The canonical SMILES for 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine is CCc1c(C)n(C)c2nc(-c3ccc(C(C)C)nc3NC)c(C)nc12.
What is the InChIKey of 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine?
The InChIKey is PKTBREYIOFYYRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5/c1-8-14-13(5)25(7)20-18(14)22-12(4)17(24-20)15-9-10-16(11(2)3)23-19(15)21-6/h9-11H,8H2,1-7H3,(H,21,23).
What are the key properties of 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine?
3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine has a molecular weight of 337.47 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-ethyl-2,5,6-trimethylpyrrolo[2,3-b]pyrazin-3-yl)-N-methyl-6-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 143015005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).