2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol

C5H11N5O — CID 130161885

IUPAC2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol
SMILESCN(CCO)Cc1nn[nH]n1
InChIInChI=1S/C5H11N5O/c1-10(2-3-11)4-5-6-8-9-7-5/h11H,2-4H2,1H3,(H,6,7,8,9)
InChIKeyLAKSPBLGSKXSDO-UHFFFAOYSA-N
MW157.18 g/mol
LogP-1.38
Rot. Bonds4

About 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol

2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol (PubChem CID 130161885) has the molecular formula C5H11N5O and a molecular weight of 157.18 g/mol. Its IUPAC name is 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol
PubChem CID130161885
Molecular FormulaC5H11N5O
Molecular Weight157.18 g/mol
Exact Mass157.10
IUPAC Name2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol
SMILESCN(CCO)Cc1nn[nH]n1
InChIInChI=1S/C5H11N5O/c1-10(2-3-11)4-5-6-8-9-7-5/h11H,2-4H2,1H3,(H,6,7,8,9)
InChIKeyLAKSPBLGSKXSDO-UHFFFAOYSA-N
XLogP-1.38
TPSA77.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.18
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol?
The IUPAC name of 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol (CID 130161885) is 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol is CN(CCO)Cc1nn[nH]n1.
What is the InChIKey of 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol?
The InChIKey is LAKSPBLGSKXSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N5O/c1-10(2-3-11)4-5-6-8-9-7-5/h11H,2-4H2,1H3,(H,6,7,8,9).
What are the key properties of 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol?
2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol has a molecular weight of 157.18 g/mol, XLogP of -1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2H-tetrazol-5-ylmethyl)amino]ethanol is sourced from PubChem (CID 130161885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).