N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine

C19H19N5OS — CID 166328871

IUPACN,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1nc(CN(C)c2nc(-c3cccnc3)nc3sc(C)c(C)c23)co1
InChIInChI=1S/C19H19N5OS/c1-11-12(2)26-19-16(11)18(24(4)9-15-10-25-13(3)21-15)22-17(23-19)14-6-5-7-20-8-14/h5-8,10H,9H2,1-4H3
InChIKeyLQUQZXWRLIBVNO-UHFFFAOYSA-N
MW365.46 g/mol
LogP4.30
Rot. Bonds4

About N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine

N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 166328871) has the molecular formula C19H19N5OS and a molecular weight of 365.46 g/mol. Its IUPAC name is N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID166328871
Molecular FormulaC19H19N5OS
Molecular Weight365.46 g/mol
Exact Mass365.13
IUPAC NameN,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1nc(CN(C)c2nc(-c3cccnc3)nc3sc(C)c(C)c23)co1
InChIInChI=1S/C19H19N5OS/c1-11-12(2)26-19-16(11)18(24(4)9-15-10-25-13(3)21-15)22-17(23-19)14-6-5-7-20-8-14/h5-8,10H,9H2,1-4H3
InChIKeyLQUQZXWRLIBVNO-UHFFFAOYSA-N
XLogP4.30
TPSA67.94 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N,5,6-trimethyl-N-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 166243723
2-[(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)-methylamino]acetic acid
CID 166237581
N,5,6-trimethyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 166225267
2-[(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)-methylamino]-N,N-diethylacetamide
CID 166186006
2-[(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)-methylamino]propan-1-ol
CID 166190654
5,6-dimethyl-2-pyridin-3-yl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 17481821
3-[(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]propan-1-ol
CID 17410711
N-(4-fluorophenyl)-5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 16553303
5,6-dimethyl-N-(4-methylpiperazin-4-ium-1-yl)-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 7927705
2-methyl-3-[methyl-(10-pyridin-3-yl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)amino]propanoic acid
CID 122064954
N-cyclopropyl-2-[(5,6-dimethyl-2-phenylthieno[2,3-d]pyrimidin-4-yl)-methylamino]acetamide
CID 27632112
4-(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)-N,N-dimethylpiperazine-1-sulfonamide
CID 154807100

Frequently Asked Questions

What is the IUPAC name of N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine (CID 166328871) is N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine is Cc1nc(CN(C)c2nc(-c3cccnc3)nc3sc(C)c(C)c23)co1.
What is the InChIKey of N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is LQUQZXWRLIBVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5OS/c1-11-12(2)26-19-16(11)18(24(4)9-15-10-25-13(3)21-15)22-17(23-19)14-6-5-7-20-8-14/h5-8,10H,9H2,1-4H3.
What are the key properties of N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine?
N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 365.46 g/mol, XLogP of 4.30, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,6-trimethyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 166328871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).