N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide

C17H19N5O2S — CID 74231062

IUPACN-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide
SMILESCOCCN(Cc1ccc(C)s1)C(=O)c1ccccc1-c1nn[nH]n1
InChIInChI=1S/C17H19N5O2S/c1-12-7-8-13(25-12)11-22(9-10-24-2)17(23)15-6-4-3-5-14(15)16-18-20-21-19-16/h3-8H,9-11H2,1-2H3,(H,18,19,20,21)
InChIKeySCGDTJONHCKULE-UHFFFAOYSA-N
MW357.44 g/mol
LogP2.53
Rot. Bonds7

About N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide

N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide (PubChem CID 74231062) has the molecular formula C17H19N5O2S and a molecular weight of 357.44 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide
PubChem CID74231062
Molecular FormulaC17H19N5O2S
Molecular Weight357.44 g/mol
Exact Mass357.13
IUPAC NameN-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide
SMILESCOCCN(Cc1ccc(C)s1)C(=O)c1ccccc1-c1nn[nH]n1
InChIInChI=1S/C17H19N5O2S/c1-12-7-8-13(25-12)11-22(9-10-24-2)17(23)15-6-4-3-5-14(15)16-18-20-21-19-16/h3-8H,9-11H2,1-2H3,(H,18,19,20,21)
InChIKeySCGDTJONHCKULE-UHFFFAOYSA-N
XLogP2.53
TPSA84.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide
CID 74241488
N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-4-tert-butyl-N-(2-methoxyethyl)benzamide
CID 5025921
N-(3-hydroxypropyl)-2-methoxy-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 46999685
N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)nonanamide
CID 3354820
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113339830
N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-4-methoxy-N-(3-methoxypropyl)benzamide
CID 4543509
1-(2-methoxyethyl)-3-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-1-[(5-methylthiophen-2-yl)methyl]urea
CID 125438850
1-(2-methoxyethyl)-3-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-1-[(5-methylthiophen-2-yl)methyl]urea
CID 122560644
[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-(2-methoxyethyl)azanium
CID 7296842
N-methyl-N-(2-pyrazol-1-ylethyl)-2-(2H-tetrazol-5-yl)benzamide
CID 74236191
N-benzyl-2-[(2-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide
CID 4239612
N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-(trifluoromethyl)benzamide
CID 4315709

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide (CID 74231062) is N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide is COCCN(Cc1ccc(C)s1)C(=O)c1ccccc1-c1nn[nH]n1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide?
The InChIKey is SCGDTJONHCKULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2S/c1-12-7-8-13(25-12)11-22(9-10-24-2)17(23)15-6-4-3-5-14(15)16-18-20-21-19-16/h3-8H,9-11H2,1-2H3,(H,18,19,20,21).
What are the key properties of N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide?
N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide has a molecular weight of 357.44 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(5-methylthiophen-2-yl)methyl]-2-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 74231062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).