5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine

C20H25N5OS — CID 141130240

IUPAC5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine
SMILESCOCCN(C)c1ccc(Nc2cccc(-c3ncc(C(C)C)s3)n2)nc1
InChIInChI=1S/C20H25N5OS/c1-14(2)17-13-22-20(27-17)16-6-5-7-19(23-16)24-18-9-8-15(12-21-18)25(3)10-11-26-4/h5-9,12-14H,10-11H2,1-4H3,(H,21,23,24)
InChIKeyCSTJYBCSNDEDEV-UHFFFAOYSA-N
MW383.52 g/mol
LogP4.55
Rot. Bonds8

About 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine

5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine (PubChem CID 141130240) has the molecular formula C20H25N5OS and a molecular weight of 383.52 g/mol. Its IUPAC name is 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine
PubChem CID141130240
Molecular FormulaC20H25N5OS
Molecular Weight383.52 g/mol
Exact Mass383.18
IUPAC Name5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine
SMILESCOCCN(C)c1ccc(Nc2cccc(-c3ncc(C(C)C)s3)n2)nc1
InChIInChI=1S/C20H25N5OS/c1-14(2)17-13-22-20(27-17)16-6-5-7-19(23-16)24-18-9-8-15(12-21-18)25(3)10-11-26-4/h5-9,12-14H,10-11H2,1-4H3,(H,21,23,24)
InChIKeyCSTJYBCSNDEDEV-UHFFFAOYSA-N
XLogP4.55
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.52
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-N-[6-(5-chloro-1,3-thiazol-2-yl)-2-pyridinyl]-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
CID 143124760
5-N-(2-methoxyethyl)-5-N-methyl-2-N-(6-pyridin-2-ylpyrazin-2-yl)pyridine-2,5-diamine
CID 91087280
N-(5-piperidin-1-yl-2-pyridinyl)-6-(5-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-amine
CID 69235905
2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
CID 71914447
6-(4-chloro-2-methylphenyl)-N-(2-methoxyethyl)-N-methylpyridin-3-amine
CID 172606837
N-(2-methoxyethyl)-N-methyl-5-[6-(3-methylanilino)-2-pyridinyl]-1,3-oxazol-2-amine
CID 53311489
N-(5-ethyl-2-pyridinyl)-6-(1,3-thiazol-2-yl)pyridin-2-amine
CID 69233935
N-(2-methoxyethyl)-N-methyl-2-propan-2-yl-1,3-benzothiazol-7-amine
CID 171441127
N-[5-[2-(2-methoxyethoxy)ethyl-methylamino]-2-pyridinyl]azetidine-3-carboxamide
CID 146314129
6-[(1R)-1-aminoethyl]-N-(3-methoxypropyl)-N-methylpyridin-3-amine
CID 83126972
(1R)-1-[5-[3-methoxypropyl(methyl)amino]-2-pyridinyl]ethanol
CID 83132161
N-(5-prop-1-en-2-yl-2-pyridinyl)-6-(1,3-thiazol-2-yl)pyridin-2-amine
CID 69235143

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine?
The IUPAC name of 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine (CID 141130240) is 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine.
What is the SMILES notation for 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine?
The canonical SMILES for 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine is COCCN(C)c1ccc(Nc2cccc(-c3ncc(C(C)C)s3)n2)nc1.
What is the InChIKey of 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine?
The InChIKey is CSTJYBCSNDEDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5OS/c1-14(2)17-13-22-20(27-17)16-6-5-7-19(23-16)24-18-9-8-15(12-21-18)25(3)10-11-26-4/h5-9,12-14H,10-11H2,1-4H3,(H,21,23,24).
What are the key properties of 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine?
5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine has a molecular weight of 383.52 g/mol, XLogP of 4.55, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxyethyl)-5-N-methyl-2-N-[6-(5-propan-2-yl-1,3-thiazol-2-yl)-2-pyridinyl]pyridine-2,5-diamine is sourced from PubChem (CID 141130240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).