5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine

C14H19N5OS — CID 72875554

IUPAC5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
SMILESCc1ncnc(NCc2csc(N3CCOCC3)n2)c1C
InChIInChI=1S/C14H19N5OS/c1-10-11(2)16-9-17-13(10)15-7-12-8-21-14(18-12)19-3-5-20-6-4-19/h8-9H,3-7H2,1-2H3,(H,15,16,17)
InChIKeyPZXMMMORFCXNPC-UHFFFAOYSA-N
MW305.41 g/mol
LogP2.00
Rot. Bonds4

About 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine

5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine (PubChem CID 72875554) has the molecular formula C14H19N5OS and a molecular weight of 305.41 g/mol. Its IUPAC name is 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
PubChem CID72875554
Molecular FormulaC14H19N5OS
Molecular Weight305.41 g/mol
Exact Mass305.13
IUPAC Name5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
SMILESCc1ncnc(NCc2csc(N3CCOCC3)n2)c1C
InChIInChI=1S/C14H19N5OS/c1-10-11(2)16-9-17-13(10)15-7-12-8-21-14(18-12)19-3-5-20-6-4-19/h8-9H,3-7H2,1-2H3,(H,15,16,17)
InChIKeyPZXMMMORFCXNPC-UHFFFAOYSA-N
XLogP2.00
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.41
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]ethanamine
CID 53507741
N-[(1,3-dimethyl-5-morpholin-4-ylpyrazol-4-yl)methyl]-1-(1,3-thiazol-4-yl)methanamine
CID 53547192
2-(1-Ethoxyethyl)-4-[[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]methyl]-1,3-thiazole
CID 71926487
N,6-dimethyl-2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholin-3-yl]pyrimidin-4-amine
CID 110113761
N,N,6-trimethyl-2-[4-(1,3-thiazol-4-ylmethyl)morpholin-3-yl]pyrimidin-4-amine
CID 110113840
N,N,6-trimethyl-2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholin-3-yl]pyrimidin-4-amine
CID 110113843
2-(methylamino)-N-{[6-(4-morpholinyl)-4-pyrimidinyl]methyl}-1,3-thiazole-4-carboxamide
CID 56894900
5,6-Dimethyl-N-[2-(4-methyl-1,3-thiazol-2-YL)ethyl]pyrimidin-4-amine
CID 72887352
N-[[2-[(1S)-1-ethoxyethyl]-1,3-thiazol-4-yl]methyl]-N,2,5,6-tetramethylpyrimidin-4-amine
CID 97227175
5-fluoro-4-morpholin-4-yl-N-[(2-propyl-1,3-thiazol-4-yl)methyl]pyrimidin-2-amine
CID 50966327
4-[6-(Difluoromethyl)pyrimidin-4-yl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 132389207
N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-5-fluoro-4-morpholin-4-ylpyrimidin-2-amine
CID 134699236

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine (CID 72875554) is 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine is Cc1ncnc(NCc2csc(N3CCOCC3)n2)c1C.
What is the InChIKey of 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine?
The InChIKey is PZXMMMORFCXNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5OS/c1-10-11(2)16-9-17-13(10)15-7-12-8-21-14(18-12)19-3-5-20-6-4-19/h8-9H,3-7H2,1-2H3,(H,15,16,17).
What are the key properties of 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine?
5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine has a molecular weight of 305.41 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-N-[(2-morpholin-4-yl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 72875554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).