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

C16H23N5OS — CID 110271890

IUPACN,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine
SMILESCc1nc(C2CN(Cc3scnc3C)CCO2)cc(N(C)C)n1
InChIInChI=1S/C16H23N5OS/c1-11-15(23-10-17-11)9-21-5-6-22-14(8-21)13-7-16(20(3)4)19-12(2)18-13/h7,10,14H,5-6,8-9H2,1-4H3
InChIKeyDCRRXFKXDATSQP-UHFFFAOYSA-N
MW333.46 g/mol
LogP2.19
Rot. Bonds4

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

N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine (PubChem CID 110271890) has the molecular formula C16H23N5OS and a molecular weight of 333.46 g/mol. Its IUPAC name is N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine
PubChem CID110271890
Molecular FormulaC16H23N5OS
Molecular Weight333.46 g/mol
Exact Mass333.16
IUPAC NameN,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine
SMILESCc1nc(C2CN(Cc3scnc3C)CCO2)cc(N(C)C)n1
InChIInChI=1S/C16H23N5OS/c1-11-15(23-10-17-11)9-21-5-6-22-14(8-21)13-7-16(20(3)4)19-12(2)18-13/h7,10,14H,5-6,8-9H2,1-4H3
InChIKeyDCRRXFKXDATSQP-UHFFFAOYSA-N
XLogP2.19
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[2-(6-Amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 110271884
[2-[2-Methyl-6-(methylamino)pyrimidin-4-yl]morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 110271885
N,2-dimethyl-6-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]pyrimidin-4-amine
CID 110271888
N,2-dimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine
CID 110271889
4-[4-(Methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole
CID 2745354
(2S)-4-(2,6-diethylpyrimidin-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 164642592
N-(2,2-difluorocyclohexyl)-6-(1-methoxyethyl)-2-(4-methyl-1,3-thiazol-2-yl)pyrimidin-4-amine
CID 132206828
1-[6-[Cyclohexyl(methyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)pyrimidin-4-yl]ethanol
CID 132206802
N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-6-(methoxymethyl)pyrimidin-4-amine
CID 72871253
[(2S)-2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 95847623
[(2R)-2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 95847624
[(2S)-2-[2-methyl-6-(methylamino)pyrimidin-4-yl]morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 95847625

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine?
The IUPAC name of N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine (CID 110271890) is N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine.
What is the SMILES notation for N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine?
The canonical SMILES for N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine is Cc1nc(C2CN(Cc3scnc3C)CCO2)cc(N(C)C)n1.
What is the InChIKey of N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine?
The InChIKey is DCRRXFKXDATSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5OS/c1-11-15(23-10-17-11)9-21-5-6-22-14(8-21)13-7-16(20(3)4)19-12(2)18-13/h7,10,14H,5-6,8-9H2,1-4H3.
What are the key properties of N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine?
N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine has a molecular weight of 333.46 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-6-[4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 110271890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).