N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide

C14H17N3OS — CID 61282011

IUPACN-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide
SMILESCc1ncc(CNCC(=O)Nc2ccccc2C)s1
InChIInChI=1S/C14H17N3OS/c1-10-5-3-4-6-13(10)17-14(18)9-15-7-12-8-16-11(2)19-12/h3-6,8,15H,7,9H2,1-2H3,(H,17,18)
InChIKeyAIVTTXWCJBBPEK-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.49
Rot. Bonds5

About N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide

N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide (PubChem CID 61282011) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide
PubChem CID61282011
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC NameN-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide
SMILESCc1ncc(CNCC(=O)Nc2ccccc2C)s1
InChIInChI=1S/C14H17N3OS/c1-10-5-3-4-6-13(10)17-14(18)9-15-7-12-8-16-11(2)19-12/h3-6,8,15H,7,9H2,1-2H3,(H,17,18)
InChIKeyAIVTTXWCJBBPEK-UHFFFAOYSA-N
XLogP2.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(2-methylphenyl)-1,3-thiazole-5-carboxamide
CID 110856576
2-(2-hydroxyphenyl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
CID 78916971
N-(2-methylphenyl)-2-[(1,3,5-trimethylpyrazol-4-yl)methylamino]acetamide
CID 78989578
2-(2-bromoprop-2-enylamino)-N-(2-methylphenyl)acetamide
CID 115745529
N-[2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]thiophen-3-yl]acetamide
CID 66385180
2-[(4-cyanophenyl)methylamino]-N-(2-methylphenyl)acetamide
CID 60918679
ethyl 2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]prop-2-enoate
CID 103243299
2-(butylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026030
1-[1-(2-methylphenyl)ethyl]-3-[(2-methyl-1,3-thiazol-5-yl)methyl]urea
CID 86841602
N-(2-methylphenyl)-3-oxobutanamide
CID 7154
2-[(2-ethyl-2-hydroxybutyl)amino]-N-(2-methylphenyl)acetamide
CID 65111167
2-[[2-(diethylamino)-2-oxoethyl]amino]-N-(2-methylphenyl)acetamide
CID 115745516

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide?
The IUPAC name of N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide (CID 61282011) is N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide.
What is the SMILES notation for N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide?
The canonical SMILES for N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide is Cc1ncc(CNCC(=O)Nc2ccccc2C)s1.
What is the InChIKey of N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide?
The InChIKey is AIVTTXWCJBBPEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-10-5-3-4-6-13(10)17-14(18)9-15-7-12-8-16-11(2)19-12/h3-6,8,15H,7,9H2,1-2H3,(H,17,18).
What are the key properties of N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide?
N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide has a molecular weight of 275.38 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetamide is sourced from PubChem (CID 61282011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).