N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine

C10H19N5O — CID 107049449

IUPACN-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
SMILESCCNC(Cc1nnn(C)n1)C1CCCO1
InChIInChI=1S/C10H19N5O/c1-3-11-8(9-5-4-6-16-9)7-10-12-14-15(2)13-10/h8-9,11H,3-7H2,1-2H3
InChIKeyKDTRAVSYAHNHGF-UHFFFAOYSA-N
MW225.30 g/mol
LogP-0.09
Rot. Bonds5

About N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine

N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine (PubChem CID 107049449) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
PubChem CID107049449
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC NameN-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
SMILESCCNC(Cc1nnn(C)n1)C1CCCO1
InChIInChI=1S/C10H19N5O/c1-3-11-8(9-5-4-6-16-9)7-10-12-14-15(2)13-10/h8-9,11H,3-7H2,1-2H3
InChIKeyKDTRAVSYAHNHGF-UHFFFAOYSA-N
XLogP-0.09
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine (CID 107049449) is N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine is CCNC(Cc1nnn(C)n1)C1CCCO1.
What is the InChIKey of N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine?
The InChIKey is KDTRAVSYAHNHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-3-11-8(9-5-4-6-16-9)7-10-12-14-15(2)13-10/h8-9,11H,3-7H2,1-2H3.
What are the key properties of N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine?
N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine has a molecular weight of 225.30 g/mol, XLogP of -0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 107049449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).