4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine

C11H14N4S — CID 79176056

IUPAC4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
SMILESCc1cc(NC(C)c2nccs2)ncc1N
InChIInChI=1S/C11H14N4S/c1-7-5-10(14-6-9(7)12)15-8(2)11-13-3-4-16-11/h3-6,8H,12H2,1-2H3,(H,14,15)
InChIKeyRHOYCDOWSPXFRO-UHFFFAOYSA-N
MW234.33 g/mol
LogP2.60
Rot. Bonds3

About 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine

4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine (PubChem CID 79176056) has the molecular formula C11H14N4S and a molecular weight of 234.33 g/mol. Its IUPAC name is 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
PubChem CID79176056
Molecular FormulaC11H14N4S
Molecular Weight234.33 g/mol
Exact Mass234.09
IUPAC Name4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine
SMILESCc1cc(NC(C)c2nccs2)ncc1N
InChIInChI=1S/C11H14N4S/c1-7-5-10(14-6-9(7)12)15-8(2)11-13-3-4-16-11/h3-6,8H,12H2,1-2H3,(H,14,15)
InChIKeyRHOYCDOWSPXFRO-UHFFFAOYSA-N
XLogP2.60
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.33
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-methyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80844662
6-hydrazinyl-2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917620
6-chloro-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-2,4-diamine
CID 78946443
6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine
CID 80917852
N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-thiazol-2-amine
CID 63612751
2,5-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CID 64988089
4-methyl-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]pyridin-3-amine
CID 96824409
6-[1-(1,3-thiazol-2-yl)ethylamino]pyridine-3-carbonitrile
CID 63611566
4-methyl-2-N-pentan-3-ylpyridine-2,5-diamine
CID 79173415
2-propyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80949949
5-bromo-4-fluoro-2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CID 103271867
6-methyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328266

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine?
The IUPAC name of 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine (CID 79176056) is 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine.
What is the SMILES notation for 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine?
The canonical SMILES for 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine is Cc1cc(NC(C)c2nccs2)ncc1N.
What is the InChIKey of 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine?
The InChIKey is RHOYCDOWSPXFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4S/c1-7-5-10(14-6-9(7)12)15-8(2)11-13-3-4-16-11/h3-6,8H,12H2,1-2H3,(H,14,15).
What are the key properties of 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine?
4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine has a molecular weight of 234.33 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-2,5-diamine is sourced from PubChem (CID 79176056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).