N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine

C14H25N3OS — CID 62767480

IUPACN-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCc1nc(N2CCOC(C)(C)C2)sc1CNC(C)C
InChIInChI=1S/C14H25N3OS/c1-10(2)15-8-12-11(3)16-13(19-12)17-6-7-18-14(4,5)9-17/h10,15H,6-9H2,1-5H3
InChIKeySWVOGXLHWDTDBS-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.56
Rot. Bonds4

About N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine

N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine (PubChem CID 62767480) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine
PubChem CID62767480
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC NameN-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCc1nc(N2CCOC(C)(C)C2)sc1CNC(C)C
InChIInChI=1S/C14H25N3OS/c1-10(2)15-8-12-11(3)16-13(19-12)17-6-7-18-14(4,5)9-17/h10,15H,6-9H2,1-5H3
InChIKeySWVOGXLHWDTDBS-UHFFFAOYSA-N
XLogP2.56
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine (CID 62767480) is N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine is Cc1nc(N2CCOC(C)(C)C2)sc1CNC(C)C.
What is the InChIKey of N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The InChIKey is SWVOGXLHWDTDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-10(2)15-8-12-11(3)16-13(19-12)17-6-7-18-14(4,5)9-17/h10,15H,6-9H2,1-5H3.
What are the key properties of N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine?
N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine has a molecular weight of 283.44 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 62767480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).