N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine

C12H16N6S — CID 124964440

IUPACN-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
SMILESCc1nc(Nc2nncs2)cc([C@H]2CCCCN2)n1
InChIInChI=1S/C12H16N6S/c1-8-15-10(9-4-2-3-5-13-9)6-11(16-8)17-12-18-14-7-19-12/h6-7,9,13H,2-5H2,1H3,(H,15,16,17,18)/t9-/m1/s1
InChIKeyHXOHLSLHHMPEPD-SECBINFHSA-N
MW276.37 g/mol
LogP2.19
Rot. Bonds3

About N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine

N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine (PubChem CID 124964440) has the molecular formula C12H16N6S and a molecular weight of 276.37 g/mol. Its IUPAC name is N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
PubChem CID124964440
Molecular FormulaC12H16N6S
Molecular Weight276.37 g/mol
Exact Mass276.12
IUPAC NameN-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
SMILESCc1nc(Nc2nncs2)cc([C@H]2CCCCN2)n1
InChIInChI=1S/C12H16N6S/c1-8-15-10(9-4-2-3-5-13-9)6-11(16-8)17-12-18-14-7-19-12/h6-7,9,13H,2-5H2,1H3,(H,15,16,17,18)/t9-/m1/s1
InChIKeyHXOHLSLHHMPEPD-SECBINFHSA-N
XLogP2.19
TPSA75.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-[2-methyl-6-[(2R)-pyrrolidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95842001
5-methyl-N-(2-methyl-6-piperidin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 175662363
N-[2-methyl-6-[(2R)-1-methylpyrrolidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95820356
2-methyl-6-[(2S)-piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 124953762
N-[6-[(2R)-1-ethylpiperidin-2-yl]-2-methylpyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95844414
N-cyclopentyl-2-methyl-6-[(2R)-pyrrolidin-2-yl]pyrimidin-4-amine
CID 95846278
N-[2-methyl-6-[(3S)-1-methylpiperidin-3-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95820358
2-methyl-6-piperidin-2-yl-N-pyrazin-2-ylpyrimidin-4-amine;hydrochloride
CID 171688192
1-[2-[2-methyl-6-(1,3,4-thiadiazol-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]ethanone
CID 110255590
N-[2-methyl-6-[1-(2-methylpropyl)pyrrolidin-3-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 110269981
N,N-dimethyl-2-[2-methyl-6-(1,3,4-thiadiazol-2-ylamino)pyrimidin-4-yl]pyrrolidine-1-sulfonamide
CID 110255655
2-amino-1-[2-[2-methyl-6-(1,3,4-thiadiazol-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]ethanone
CID 110089950

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine (CID 124964440) is N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine is Cc1nc(Nc2nncs2)cc([C@H]2CCCCN2)n1.
What is the InChIKey of N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine?
The InChIKey is HXOHLSLHHMPEPD-SECBINFHSA-N. The full InChI is InChI=1S/C12H16N6S/c1-8-15-10(9-4-2-3-5-13-9)6-11(16-8)17-12-18-14-7-19-12/h6-7,9,13H,2-5H2,1H3,(H,15,16,17,18)/t9-/m1/s1.
What are the key properties of N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine?
N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine has a molecular weight of 276.37 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-6-[(2R)-piperidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 124964440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).