N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine

C10H15N5S — CID 103086139

IUPACN-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1Cc1ccsc1
InChIInChI=1S/C10H15N5S/c1-3-11-8(2)10-12-13-14-15(10)6-9-4-5-16-7-9/h4-5,7-8,11H,3,6H2,1-2H3
InChIKeyKTRCESSXOUJDKI-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.45
Rot. Bonds5

About N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine

N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine (PubChem CID 103086139) has the molecular formula C10H15N5S and a molecular weight of 237.33 g/mol. Its IUPAC name is N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine
PubChem CID103086139
Molecular FormulaC10H15N5S
Molecular Weight237.33 g/mol
Exact Mass237.10
IUPAC NameN-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1Cc1ccsc1
InChIInChI=1S/C10H15N5S/c1-3-11-8(2)10-12-13-14-15(10)6-9-4-5-16-7-9/h4-5,7-8,11H,3,6H2,1-2H3
InChIKeyKTRCESSXOUJDKI-UHFFFAOYSA-N
XLogP1.45
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-1-[1-(2-thiophen-3-ylethyl)tetrazol-5-yl]ethanamine
CID 103085887
N-[1-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]ethyl]-2-methylpropan-1-amine
CID 103085288
N-ethyl-1-[1-(2-phenylethyl)tetrazol-5-yl]ethanamine
CID 103085404
N-[1-[1-[(3-bromophenyl)methyl]tetrazol-5-yl]ethyl]-2-methylpropan-1-amine
CID 103085946
1-[1-[2-(4-chlorophenyl)ethyl]tetrazol-5-yl]-N-ethylethanamine
CID 103085817
1-[1-(3,3-dimethylbutyl)tetrazol-5-yl]-N-ethylethanamine
CID 103087021
1-ethyl-N-(thiophen-3-ylmethyl)tetrazol-5-amine
CID 4727838
N-ethyl-1-[1-(3-methylsulfanylpropyl)tetrazol-5-yl]ethanamine
CID 103086230
N-ethyl-1-[1-[2-(4-nitrophenyl)ethyl]tetrazol-5-yl]ethanamine
CID 103085672
N-[[1-(1-thiophen-3-ylpropan-2-yl)tetrazol-5-yl]methyl]ethanamine
CID 62763674
1-propyl-N-(thiophen-3-ylmethyl)tetrazol-5-amine
CID 4726983
1-[1-(3-ethoxypropyl)tetrazol-5-yl]-N-ethylethanamine
CID 103085441

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine (CID 103086139) is N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine is CCNC(C)c1nnnn1Cc1ccsc1.
What is the InChIKey of N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine?
The InChIKey is KTRCESSXOUJDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5S/c1-3-11-8(2)10-12-13-14-15(10)6-9-4-5-16-7-9/h4-5,7-8,11H,3,6H2,1-2H3.
What are the key properties of N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine?
N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine has a molecular weight of 237.33 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(thiophen-3-ylmethyl)tetrazol-5-yl]ethanamine is sourced from PubChem (CID 103086139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).