N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide

C7H13N5O3 — CID 110498014

IUPACN,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide
SMILESO=C(Cc1nn[nH]n1)N(CCO)CCO
InChIInChI=1S/C7H13N5O3/c13-3-1-12(2-4-14)7(15)5-6-8-10-11-9-6/h13-14H,1-5H2,(H,8,9,10,11)
InChIKeyZNLWARXGXXFGAW-UHFFFAOYSA-N
MW215.21 g/mol
LogP-2.44
Rot. Bonds6

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

N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide (PubChem CID 110498014) has the molecular formula C7H13N5O3 and a molecular weight of 215.21 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide
PubChem CID110498014
Molecular FormulaC7H13N5O3
Molecular Weight215.21 g/mol
Exact Mass215.10
IUPAC NameN,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide
SMILESO=C(Cc1nn[nH]n1)N(CCO)CCO
InChIInChI=1S/C7H13N5O3/c13-3-1-12(2-4-14)7(15)5-6-8-10-11-9-6/h13-14H,1-5H2,(H,8,9,10,11)
InChIKeyZNLWARXGXXFGAW-UHFFFAOYSA-N
XLogP-2.44
TPSA115.23 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 5-2.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide (CID 110498014) is N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide is O=C(Cc1nn[nH]n1)N(CCO)CCO.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide?
The InChIKey is ZNLWARXGXXFGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5O3/c13-3-1-12(2-4-14)7(15)5-6-8-10-11-9-6/h13-14H,1-5H2,(H,8,9,10,11).
What are the key properties of N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide?
N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide has a molecular weight of 215.21 g/mol, XLogP of -2.44, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-2-(2H-tetrazol-5-yl)acetamide is sourced from PubChem (CID 110498014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).