N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide

C10H12F3N3OS — CID 136535644

IUPACN-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide
SMILESO=C(CNc1ncc(C(F)(F)F)s1)NCC1CC1
InChIInChI=1S/C10H12F3N3OS/c11-10(12,13)7-4-15-9(18-7)16-5-8(17)14-3-6-1-2-6/h4,6H,1-3,5H2,(H,14,17)(H,15,16)
InChIKeyDXNGUISZQMEWJY-UHFFFAOYSA-N
MW279.29 g/mol
LogP2.10
Rot. Bonds5

About N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide

N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide (PubChem CID 136535644) has the molecular formula C10H12F3N3OS and a molecular weight of 279.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide
PubChem CID136535644
Molecular FormulaC10H12F3N3OS
Molecular Weight279.29 g/mol
Exact Mass279.07
IUPAC NameN-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide
SMILESO=C(CNc1ncc(C(F)(F)F)s1)NCC1CC1
InChIInChI=1S/C10H12F3N3OS/c11-10(12,13)7-4-15-9(18-7)16-5-8(17)14-3-6-1-2-6/h4,6H,1-3,5H2,(H,14,17)(H,15,16)
InChIKeyDXNGUISZQMEWJY-UHFFFAOYSA-N
XLogP2.10
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylbutylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 4334665
N-[2,2,2-trifluoro-1-[(5-methyl-1,3-thiazol-2-yl)amino]-1-(trifluoromethyl)ethyl]propanamide
CID 1208101
3-methyl-N-[2,2,2-trifluoro-1-[(5-methyl-1,3-thiazol-2-yl)amino]-1-(trifluoromethyl)ethyl]butanamide
CID 1717062
2,2-dimethyl-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]propanamide
CID 16293434
1-[5-(Trifluoromethyl)-1,3-thiazol-2-yl]-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
CID 137992338
(1R)-2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
CID 164633885
(2S)-N-cyclopropyl-1-[5-(trifluoromethyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide
CID 164639916
3-(Methylamino)-1-[5-(trifluoromethyl)-1,3-thiazol-2-yl]pyrrolidin-2-one
CID 22909972
N-[5-[(2-aminoethylamino)methyl]-1,3-thiazol-2-yl]-2,2,2-trifluoroacetamide
CID 88680398
N-[5-(trifluoromethyl)-1,3-thiazol-2-yl]butanamide
CID 151164719
N-[1,1,1,3,3,3-hexafluoro-2-[(5-methyl-1,3-thiazol-2-yl)amino]propan-2-yl]acetamide
CID 1208098
N-[5-(3-aminoprop-1-ynyl)-1,3-thiazol-2-yl]-3,3,3-trifluoropropanamide
CID 54922674

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide (CID 136535644) is N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide is O=C(CNc1ncc(C(F)(F)F)s1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide?
The InChIKey is DXNGUISZQMEWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3OS/c11-10(12,13)7-4-15-9(18-7)16-5-8(17)14-3-6-1-2-6/h4,6H,1-3,5H2,(H,14,17)(H,15,16).
What are the key properties of N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide?
N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide has a molecular weight of 279.29 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[[5-(trifluoromethyl)-1,3-thiazol-2-yl]amino]acetamide is sourced from PubChem (CID 136535644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).