N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine

C8H10ClN5S — CID 63150290

IUPACN-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine
SMILESCC(Nc1nnnn1C)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClN5S/c1-5(6-3-4-7(9)15-6)10-8-11-12-13-14(8)2/h3-5H,1-2H3,(H,10,11,13)
InChIKeyGIYGXHACTVRGDS-UHFFFAOYSA-N
MW243.72 g/mol
LogP2.10
Rot. Bonds3

About N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine

N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine (PubChem CID 63150290) has the molecular formula C8H10ClN5S and a molecular weight of 243.72 g/mol. Its IUPAC name is N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine.

Molecular Properties

Compound NameN-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine
PubChem CID63150290
Molecular FormulaC8H10ClN5S
Molecular Weight243.72 g/mol
Exact Mass243.03
IUPAC NameN-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine
SMILESCC(Nc1nnnn1C)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClN5S/c1-5(6-3-4-7(9)15-6)10-8-11-12-13-14(8)2/h3-5H,1-2H3,(H,10,11,13)
InChIKeyGIYGXHACTVRGDS-UHFFFAOYSA-N
XLogP2.10
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.72
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-1-methyltetrazol-5-amine
CID 63149791
N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-1-methyltetrazol-5-amine
CID 167808600
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517
1-methyl-N-(1-pyridin-3-ylethyl)tetrazol-5-amine
CID 63152413
3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]aniline
CID 43438966
N-[1-(5-chlorothiophen-2-yl)ethyl]-4-propan-2-ylaniline
CID 43381993
N'-[1-(5-chlorothiophen-2-yl)ethyl]ethane-1,2-diamine
CID 60887972
1-(5-chlorothiophen-2-yl)-N-[(3-methyltriazol-4-yl)methyl]ethanamine
CID 115682250
N-[1-(5-chlorothiophen-2-yl)ethyl]-2-propan-2-ylaniline
CID 43381990
N-[1-(5-chlorothiophen-2-yl)ethyl]-1-cyclopentyl-4-methylimidazol-2-amine
CID 106564534
N-[1-(5-chlorothiophen-2-yl)ethyl]-5-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
CID 106260130
1-[1-(5-chlorothiophen-2-yl)ethyl]tetrazol-5-amine
CID 79506894

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine?
The IUPAC name of N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine (CID 63150290) is N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine.
What is the SMILES notation for N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine?
The canonical SMILES for N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine is CC(Nc1nnnn1C)c1ccc(Cl)s1.
What is the InChIKey of N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine?
The InChIKey is GIYGXHACTVRGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN5S/c1-5(6-3-4-7(9)15-6)10-8-11-12-13-14(8)2/h3-5H,1-2H3,(H,10,11,13).
What are the key properties of N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine?
N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine has a molecular weight of 243.72 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-chlorothiophen-2-yl)ethyl]-1-methyltetrazol-5-amine is sourced from PubChem (CID 63150290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).