6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile

C11H10N4S — CID 64588768

IUPAC6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile
SMILESCc1csc(CNc2cccc(C#N)n2)n1
InChIInChI=1S/C11H10N4S/c1-8-7-16-11(14-8)6-13-10-4-2-3-9(5-12)15-10/h2-4,7H,6H2,1H3,(H,13,15)
InChIKeyLXDQRHVTFFUMAN-UHFFFAOYSA-N
MW230.30 g/mol
LogP2.33
Rot. Bonds3

About 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile

6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile (PubChem CID 64588768) has the molecular formula C11H10N4S and a molecular weight of 230.30 g/mol. Its IUPAC name is 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile
PubChem CID64588768
Molecular FormulaC11H10N4S
Molecular Weight230.30 g/mol
Exact Mass230.06
IUPAC Name6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile
SMILESCc1csc(CNc2cccc(C#N)n2)n1
InChIInChI=1S/C11H10N4S/c1-8-7-16-11(14-8)6-13-10-4-2-3-9(5-12)15-10/h2-4,7H,6H2,1H3,(H,13,15)
InChIKeyLXDQRHVTFFUMAN-UHFFFAOYSA-N
XLogP2.33
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[2-[[(6-cyano-2-pyridinyl)amino]methyl]-1,3-thiazol-4-yl]acetate
CID 154844984
6-[[2-(2-phenylethyl)-1,3-thiazol-4-yl]methylamino]pyridine-2-carbonitrile
CID 133392835
4,6-dimethyl-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile
CID 55026390
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-2-amine
CID 60706641
2,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidin-4-amine
CID 60733823
6-[[4-(aminomethyl)phenyl]methylamino]pyridine-2-carbonitrile
CID 81090675
4,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
CID 115750507
2-amino-5-[(4-methyl-1,3-thiazol-2-yl)methylamino]benzonitrile
CID 113323900
5,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrazin-2-amine
CID 114475451
3-chloro-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-4-carbonitrile
CID 107057231
3-amino-2-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-4-carbonitrile
CID 82816661
6-(1,2,4-oxadiazol-3-ylmethylamino)pyridine-2-carbonitrile
CID 106398793

Frequently Asked Questions

What is the IUPAC name of 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile?
The IUPAC name of 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile (CID 64588768) is 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile is Cc1csc(CNc2cccc(C#N)n2)n1.
What is the InChIKey of 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile?
The InChIKey is LXDQRHVTFFUMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4S/c1-8-7-16-11(14-8)6-13-10-4-2-3-9(5-12)15-10/h2-4,7H,6H2,1H3,(H,13,15).
What are the key properties of 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile?
6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile has a molecular weight of 230.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-methyl-1,3-thiazol-2-yl)methylamino]pyridine-2-carbonitrile is sourced from PubChem (CID 64588768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).