N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide

C12H21N3OS — CID 51076387

IUPACN,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
SMILESCCCc1nc(CN(C)CC(=O)N(C)C)cs1
InChIInChI=1S/C12H21N3OS/c1-5-6-11-13-10(9-17-11)7-15(4)8-12(16)14(2)3/h9H,5-8H2,1-4H3
InChIKeyYRDZBAWKYSJPSM-UHFFFAOYSA-N
MW255.39 g/mol
LogP1.62
Rot. Bonds6

About N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide

N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide (PubChem CID 51076387) has the molecular formula C12H21N3OS and a molecular weight of 255.39 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
PubChem CID51076387
Molecular FormulaC12H21N3OS
Molecular Weight255.39 g/mol
Exact Mass255.14
IUPAC NameN,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
SMILESCCCc1nc(CN(C)CC(=O)N(C)C)cs1
InChIInChI=1S/C12H21N3OS/c1-5-6-11-13-10(9-17-11)7-15(4)8-12(16)14(2)3/h9H,5-8H2,1-4H3
InChIKeyYRDZBAWKYSJPSM-UHFFFAOYSA-N
XLogP1.62
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.39
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide
CID 86919880
2-[(2-tert-butyl-1,3-thiazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide
CID 51078859
ethyl 3-[[2-[2-(dimethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl-methylamino]propanoate
CID 62011847
3-[ethyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]propanoic acid
CID 61009223
N',2,2-trimethyl-N'-[(2-propyl-1,3-thiazol-4-yl)methyl]propane-1,3-diamine;dihydrochloride
CID 119928878
2-[prop-2-enyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetic acid
CID 79275716
2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 89272133
N-methyl-2-piperazin-1-yl-N-[(2-propyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 63265394
4-[[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]methyl]oxan-4-ol
CID 114952911
ethane;2-(2-propyl-1,3-thiazol-4-yl)acetamide
CID 143669035
methyl 2-[cyclopentyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetate
CID 80709452
N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-propyl-1,3-thiazol-4-yl)methanamine
CID 134052869

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide (CID 51076387) is N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide is CCCc1nc(CN(C)CC(=O)N(C)C)cs1.
What is the InChIKey of N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The InChIKey is YRDZBAWKYSJPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3OS/c1-5-6-11-13-10(9-17-11)7-15(4)8-12(16)14(2)3/h9H,5-8H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide?
N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide has a molecular weight of 255.39 g/mol, XLogP of 1.62, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]acetamide is sourced from PubChem (CID 51076387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).