N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide

C6H11N5O2 — CID 110498044

IUPACN-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide
SMILESCN(CCO)C(=O)Cc1nn[nH]n1
InChIInChI=1S/C6H11N5O2/c1-11(2-3-12)6(13)4-5-7-9-10-8-5/h12H,2-4H2,1H3,(H,7,8,9,10)
InChIKeyRRXDJGJRZDMXOU-UHFFFAOYSA-N
MW185.19 g/mol
LogP-1.81
Rot. Bonds4

About N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide

N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide (PubChem CID 110498044) has the molecular formula C6H11N5O2 and a molecular weight of 185.19 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide
PubChem CID110498044
Molecular FormulaC6H11N5O2
Molecular Weight185.19 g/mol
Exact Mass185.09
IUPAC NameN-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide
SMILESCN(CCO)C(=O)Cc1nn[nH]n1
InChIInChI=1S/C6H11N5O2/c1-11(2-3-12)6(13)4-5-7-9-10-8-5/h12H,2-4H2,1H3,(H,7,8,9,10)
InChIKeyRRXDJGJRZDMXOU-UHFFFAOYSA-N
XLogP-1.81
TPSA95.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 5-1.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide (CID 110498044) is N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide is CN(CCO)C(=O)Cc1nn[nH]n1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide?
The InChIKey is RRXDJGJRZDMXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O2/c1-11(2-3-12)6(13)4-5-7-9-10-8-5/h12H,2-4H2,1H3,(H,7,8,9,10).
What are the key properties of N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide?
N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide has a molecular weight of 185.19 g/mol, XLogP of -1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-2-(2H-tetrazol-5-yl)acetamide is sourced from PubChem (CID 110498044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).