2-[(1-methyltetrazol-5-yl)-propylamino]ethanol

C7H15N5O — CID 63149759

IUPAC2-[(1-methyltetrazol-5-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nnnn1C
InChIInChI=1S/C7H15N5O/c1-3-4-12(5-6-13)7-8-9-10-11(7)2/h13H,3-6H2,1-2H3
InChIKeyDYFNRAPURSGNPE-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.58
Rot. Bonds5

About 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol

2-[(1-methyltetrazol-5-yl)-propylamino]ethanol (PubChem CID 63149759) has the molecular formula C7H15N5O and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(1-methyltetrazol-5-yl)-propylamino]ethanol
PubChem CID63149759
Molecular FormulaC7H15N5O
Molecular Weight185.23 g/mol
Exact Mass185.13
IUPAC Name2-[(1-methyltetrazol-5-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1nnnn1C
InChIInChI=1S/C7H15N5O/c1-3-4-12(5-6-13)7-8-9-10-11(7)2/h13H,3-6H2,1-2H3
InChIKeyDYFNRAPURSGNPE-UHFFFAOYSA-N
XLogP-0.58
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol?
The IUPAC name of 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol (CID 63149759) is 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol.
What is the SMILES notation for 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol?
The canonical SMILES for 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol is CCCN(CCO)c1nnnn1C.
What is the InChIKey of 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol?
The InChIKey is DYFNRAPURSGNPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N5O/c1-3-4-12(5-6-13)7-8-9-10-11(7)2/h13H,3-6H2,1-2H3.
What are the key properties of 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol?
2-[(1-methyltetrazol-5-yl)-propylamino]ethanol has a molecular weight of 185.23 g/mol, XLogP of -0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methyltetrazol-5-yl)-propylamino]ethanol is sourced from PubChem (CID 63149759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).