N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine

C11H23N5 — CID 103087026

IUPACN-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1CC(CC)CC
InChIInChI=1S/C11H23N5/c1-5-10(6-2)8-16-11(13-14-15-16)9(4)12-7-3/h9-10,12H,5-8H2,1-4H3
InChIKeyXESXGOSLXMIJJG-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.78
Rot. Bonds7

About N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine

N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine (PubChem CID 103087026) has the molecular formula C11H23N5 and a molecular weight of 225.34 g/mol. Its IUPAC name is N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine
PubChem CID103087026
Molecular FormulaC11H23N5
Molecular Weight225.34 g/mol
Exact Mass225.20
IUPAC NameN-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1CC(CC)CC
InChIInChI=1S/C11H23N5/c1-5-10(6-2)8-16-11(13-14-15-16)9(4)12-7-3/h9-10,12H,5-8H2,1-4H3
InChIKeyXESXGOSLXMIJJG-UHFFFAOYSA-N
XLogP1.78
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(3,3-dimethylbutyl)tetrazol-5-yl]-N-ethylethanamine
CID 103087021
N-ethyl-1-[1-(3-methylsulfanylpropyl)tetrazol-5-yl]ethanamine
CID 103086230
1-[1-(3-ethoxypropyl)tetrazol-5-yl]-N-ethylethanamine
CID 103085441
N-ethyl-1-(1-hexan-3-yltetrazol-5-yl)ethanamine
CID 103085598
N-ethyl-1-[1-[2-(2-methylpropoxy)ethyl]tetrazol-5-yl]ethanamine
CID 103087047
N-ethyl-1-[1-[(1-ethylcyclopentyl)methyl]tetrazol-5-yl]ethanamine
CID 114125135
N-ethyl-1-[1-(2-phenylethyl)tetrazol-5-yl]ethanamine
CID 103085404
N-[1-[1-(2,3-dimethoxypropyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 114102047
N-[1-(1-propyltetrazol-5-yl)ethyl]propan-1-amine
CID 103085432
N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine
CID 103086139
1-[1-[2-(4-chlorophenyl)ethyl]tetrazol-5-yl]-N-ethylethanamine
CID 103085817
N-ethyl-1-[1-[2-(4-methylcyclohexyl)ethyl]tetrazol-5-yl]ethanamine
CID 103086274

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine (CID 103087026) is N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine is CCNC(C)c1nnnn1CC(CC)CC.
What is the InChIKey of N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine?
The InChIKey is XESXGOSLXMIJJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5/c1-5-10(6-2)8-16-11(13-14-15-16)9(4)12-7-3/h9-10,12H,5-8H2,1-4H3.
What are the key properties of N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine?
N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine has a molecular weight of 225.34 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(2-ethylbutyl)tetrazol-5-yl]ethanamine is sourced from PubChem (CID 103087026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).