N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide

C11H13N5OS — CID 856765

IUPACN-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2cccs2)n1)NCC1CC1
InChIInChI=1S/C11H13N5OS/c17-10(12-6-8-3-4-8)7-16-14-11(13-15-16)9-2-1-5-18-9/h1-2,5,8H,3-4,6-7H2,(H,12,17)
InChIKeySHCYLHNZPRKQRK-UHFFFAOYSA-N
MW263.33 g/mol
LogP0.93
Rot. Bonds5

About N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide

N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide (PubChem CID 856765) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
PubChem CID856765
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC NameN-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
SMILESO=C(Cn1nnc(-c2cccs2)n1)NCC1CC1
InChIInChI=1S/C11H13N5OS/c17-10(12-6-8-3-4-8)7-16-14-11(13-15-16)9-2-1-5-18-9/h1-2,5,8H,3-4,6-7H2,(H,12,17)
InChIKeySHCYLHNZPRKQRK-UHFFFAOYSA-N
XLogP0.93
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]acetic acid
CID 43354422
3-[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]propanoic acid
CID 43354761
1-[[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 115449963
N-(2,3-dihydroxypropyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 66175567
N-(6-hydroxyhexyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 107843843
N-(5-hydroxypentyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 107318928
propan-2-yl 2-(5-thiophen-2-yltetrazol-2-yl)acetate
CID 862090
N-[2-(2,4-dichlorophenyl)ethyl]-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 26245507
N-(1H-pyrazol-5-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 61393718
N-(1-hydroxybutan-2-yl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 43393225
N-(2-ethylphenyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide
CID 646110
3-methyl-3-[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]butanoic acid
CID 64670550

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide (CID 856765) is N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide is O=C(Cn1nnc(-c2cccs2)n1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
The InChIKey is SHCYLHNZPRKQRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c17-10(12-6-8-3-4-8)7-16-14-11(13-15-16)9-2-1-5-18-9/h1-2,5,8H,3-4,6-7H2,(H,12,17).
What are the key properties of N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide?
N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide has a molecular weight of 263.33 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(5-thiophen-2-yltetrazol-2-yl)acetamide is sourced from PubChem (CID 856765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).