5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine

C27H37N7O — CID 72831171

IUPAC5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine
SMILESCCOC1CN(c2ccccn2)CC1Nc1nc(CC)c(-c2cnc(N(C)C)cc2C)nc1CC
InChIInChI=1S/C27H37N7O/c1-7-20-26(19-15-29-25(33(5)6)14-18(19)4)30-21(8-2)27(31-20)32-22-16-34(17-23(22)35-9-3)24-12-10-11-13-28-24/h10-15,22-23H,7-9,16-17H2,1-6H3,(H,31,32)
InChIKeyCOAVLFRSKFHCJB-UHFFFAOYSA-N
MW475.64 g/mol
LogP4.14
Rot. Bonds9

About 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine

5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine (PubChem CID 72831171) has the molecular formula C27H37N7O and a molecular weight of 475.64 g/mol. Its IUPAC name is 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine.

Molecular Properties

Compound Name5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine
PubChem CID72831171
Molecular FormulaC27H37N7O
Molecular Weight475.64 g/mol
Exact Mass475.31
IUPAC Name5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine
SMILESCCOC1CN(c2ccccn2)CC1Nc1nc(CC)c(-c2cnc(N(C)C)cc2C)nc1CC
InChIInChI=1S/C27H37N7O/c1-7-20-26(19-15-29-25(33(5)6)14-18(19)4)30-21(8-2)27(31-20)32-22-16-34(17-23(22)35-9-3)24-12-10-11-13-28-24/h10-15,22-23H,7-9,16-17H2,1-6H3,(H,31,32)
InChIKeyCOAVLFRSKFHCJB-UHFFFAOYSA-N
XLogP4.14
TPSA79.30 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.64
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-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

5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-[(3R,4S)-4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl]-3,6-diethylpyrazin-2-amine
CID 11397375
N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethyl-5-(6-methoxy-2-methyl-3-pyridinyl)pyrazin-2-amine
CID 72753389
5-(2-chloro-4-methoxyphenyl)-N-[(3R,4S)-4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl]-3,6-diethylpyrazin-2-amine
CID 11167579
5-(2-chloro-4-methoxyphenyl)-N-[(3R,4S)-4-ethoxy-1-(4-methoxy-2-pyridinyl)pyrrolidin-3-yl]-3,6-diethylpyrazin-2-amine
CID 58914565
6-cyclopropyl-5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-[(2S)-2-ethoxy-2,3-dihydro-1H-inden-1-yl]-3-ethylpyrazin-2-amine
CID 59083179
(2S)-1-[[3-cyclopropyl-5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-6-ethylpyrazin-2-yl]amino]-2,3-dihydro-1H-inden-2-ol
CID 59083146
2-[6-(dimethylamino)-4-methyl-3-pyridinyl]-5-[(2-ethoxy-2,3-dihydro-1H-inden-1-yl)amino]-6-ethyl-3-methylpyrimidin-4-one
CID 21018482
1-[3-[[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino]-4-ethoxypyrrolidin-1-yl]butan-1-one
CID 10217448
5-[2-chloro-4-(dimethylamino)phenyl]-N-[(1R,2S)-2-ethoxy-2,3-dihydro-1H-inden-1-yl]-3,6-diethylpyrazin-2-amine
CID 10238643
[1-[[2-[6-(dimethylamino)-4-methyl-3-pyridinyl]-4-ethyl-1-methyl-6-oxopyrimidin-5-yl]amino]-2,3-dihydro-1H-inden-2-yl] acetate
CID 21018432
2-[2-chloro-4-(trifluoromethyl)phenyl]-5-[[(4S)-4-ethoxy-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]amino]-3-ethyl-6-methylpyrimidin-4-one;2-[4-(dimethylamino)-2-methylphenyl]-5-[[(4S)-4-ethoxy-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]amino]-3-ethyl-6-methylpyrimidin-4-one;2-[6-(dimethylamino)-4-methyl-3-pyridinyl]-5-[[(4S)-4-ethoxy-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]amino]-3-ethyl-6-methylpyrimidin-4-one;5-[[(4S)-4-ethoxy-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]amino]-3-ethyl-2-(6-methoxy-2-methyl-3-pyridinyl)-6-methylpyrimidin-4-one
CID 158884020
methyl 3-[[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino]-4-propoxypyrrolidine-1-carboxylate
CID 22147370

Frequently Asked Questions

What is the IUPAC name of 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine?
The IUPAC name of 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine (CID 72831171) is 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine.
What is the SMILES notation for 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine?
The canonical SMILES for 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine is CCOC1CN(c2ccccn2)CC1Nc1nc(CC)c(-c2cnc(N(C)C)cc2C)nc1CC.
What is the InChIKey of 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine?
The InChIKey is COAVLFRSKFHCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37N7O/c1-7-20-26(19-15-29-25(33(5)6)14-18(19)4)30-21(8-2)27(31-20)32-22-16-34(17-23(22)35-9-3)24-12-10-11-13-28-24/h10-15,22-23H,7-9,16-17H2,1-6H3,(H,31,32).
What are the key properties of 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine?
5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine has a molecular weight of 475.64 g/mol, XLogP of 4.14, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(dimethylamino)-4-methyl-3-pyridinyl]-N-(4-ethoxy-1-pyridin-2-ylpyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine is sourced from PubChem (CID 72831171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).