N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine

C14H20N4S — CID 133308441

IUPACN,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(N(C)Cc2nc(C)cs2)nc(C(C)C)n1
InChIInChI=1S/C14H20N4S/c1-9(2)14-16-10(3)6-12(17-14)18(5)7-13-15-11(4)8-19-13/h6,8-9H,7H2,1-5H3
InChIKeyZSPVBIJVQHWIRN-UHFFFAOYSA-N
MW276.41 g/mol
LogP3.31
Rot. Bonds4

About N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine

N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine (PubChem CID 133308441) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine
PubChem CID133308441
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC NameN,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(N(C)Cc2nc(C)cs2)nc(C(C)C)n1
InChIInChI=1S/C14H20N4S/c1-9(2)14-16-10(3)6-12(17-14)18(5)7-13-15-11(4)8-19-13/h6,8-9H,7H2,1-5H3
InChIKeyZSPVBIJVQHWIRN-UHFFFAOYSA-N
XLogP3.31
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine (CID 133308441) is N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine is Cc1cc(N(C)Cc2nc(C)cs2)nc(C(C)C)n1.
What is the InChIKey of N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is ZSPVBIJVQHWIRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-9(2)14-16-10(3)6-12(17-14)18(5)7-13-15-11(4)8-19-13/h6,8-9H,7H2,1-5H3.
What are the key properties of N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine?
N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 276.41 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 133308441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).