1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine

C8H17N5O — CID 103085409

IUPAC1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine
SMILESCCn1nnnc1C(C)NCCOC
InChIInChI=1S/C8H17N5O/c1-4-13-8(10-11-12-13)7(2)9-5-6-14-3/h7,9H,4-6H2,1-3H3
InChIKeyUTDPLSCABPRGQD-UHFFFAOYSA-N
MW199.26 g/mol
LogP-0.01
Rot. Bonds6

About 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine

1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine (PubChem CID 103085409) has the molecular formula C8H17N5O and a molecular weight of 199.26 g/mol. Its IUPAC name is 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine.

Molecular Properties

Compound Name1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine
PubChem CID103085409
Molecular FormulaC8H17N5O
Molecular Weight199.26 g/mol
Exact Mass199.14
IUPAC Name1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine
SMILESCCn1nnnc1C(C)NCCOC
InChIInChI=1S/C8H17N5O/c1-4-13-8(10-11-12-13)7(2)9-5-6-14-3/h7,9H,4-6H2,1-3H3
InChIKeyUTDPLSCABPRGQD-UHFFFAOYSA-N
XLogP-0.01
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[1-[(4-bromophenyl)methyl]tetrazol-5-yl]-N-(2-methoxyethyl)ethanamine
CID 103085480
N-(2-methoxyethyl)-1-[1-(2-methyl-2-methylsulfonylpropyl)tetrazol-5-yl]ethanamine
CID 103086514
N-(2-methoxyethyl)-1-[1-(3-phenylpropyl)tetrazol-5-yl]ethanamine
CID 103085538
N-(2-methoxyethyl)-1-[1-(2,2,3,3-tetramethylcyclopropyl)tetrazol-5-yl]ethanamine
CID 103086509
N-(2-methoxyethyl)-1-[1-(2-thiophen-3-ylethyl)tetrazol-5-yl]ethanamine
CID 103085887
N-(2-methoxyethyl)-1-[1-[2-(3-methylphenyl)ethyl]tetrazol-5-yl]ethanamine
CID 103085567
1-[1-[2-(5-chlorothiophen-2-yl)ethyl]tetrazol-5-yl]-N-(2-methoxyethyl)ethanamine
CID 106043176
N-[1-[1-(2,3-dimethoxypropyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 114102047
1-(1-hexan-2-yltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine
CID 103085593
N-(2-methoxyethyl)-1-[1-[2-(3-methylcyclohexyl)ethyl]tetrazol-5-yl]ethanamine
CID 103086270
N-[1-(1-propyltetrazol-5-yl)ethyl]propan-1-amine
CID 103085432
N-(2-methoxyethyl)-1-[1-(thian-4-yl)tetrazol-5-yl]ethanamine
CID 103087012

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine?
The IUPAC name of 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine (CID 103085409) is 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine.
What is the SMILES notation for 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine?
The canonical SMILES for 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine is CCn1nnnc1C(C)NCCOC.
What is the InChIKey of 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine?
The InChIKey is UTDPLSCABPRGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N5O/c1-4-13-8(10-11-12-13)7(2)9-5-6-14-3/h7,9H,4-6H2,1-3H3.
What are the key properties of 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine?
1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine has a molecular weight of 199.26 g/mol, XLogP of -0.01, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine is sourced from PubChem (CID 103085409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).