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

C8H14FN5 — CID 130727764

IUPACN-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine
SMILESCn1nnnc1NCCC1(F)CCC1
InChIInChI=1S/C8H14FN5/c1-14-7(11-12-13-14)10-6-5-8(9)3-2-4-8/h2-6H2,1H3,(H,10,11,13)
InChIKeyANPCAUXCCOENHH-UHFFFAOYSA-N
MW199.23 g/mol
LogP0.90
Rot. Bonds4

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

N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine (PubChem CID 130727764) has the molecular formula C8H14FN5 and a molecular weight of 199.23 g/mol. Its IUPAC name is N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine.

Molecular Properties

Compound NameN-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine
PubChem CID130727764
Molecular FormulaC8H14FN5
Molecular Weight199.23 g/mol
Exact Mass199.12
IUPAC NameN-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine
SMILESCn1nnnc1NCCC1(F)CCC1
InChIInChI=1S/C8H14FN5/c1-14-7(11-12-13-14)10-6-5-8(9)3-2-4-8/h2-6H2,1H3,(H,10,11,13)
InChIKeyANPCAUXCCOENHH-UHFFFAOYSA-N
XLogP0.90
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(1-methyltetrazol-5-yl)amino]ethanol
CID 63152176
N-(3-methoxypropyl)-1-methyltetrazol-5-amine
CID 63152228
N',N'-dimethyl-N-(1-methyltetrazol-5-yl)ethane-1,2-diamine
CID 63152406
N-[[1-(dimethylamino)cyclopropyl]methyl]-1-methyltetrazol-5-amine
CID 127017131
N-[[1-(chloromethyl)cyclopentyl]methyl]-1-methyltetrazol-5-amine
CID 115363664
N'-(1-methyltetrazol-5-yl)butane-1,4-diamine
CID 63152546
N-(3-ethoxypropyl)-1-methyltetrazol-5-amine
CID 63152129
N-(2,2-difluoroethyl)-1-methyltetrazol-5-amine
CID 79099576
N-[2-(2-fluorophenyl)ethyl]-1-methyltetrazol-5-amine
CID 63151902
1-methyl-N-(2-pyrrolidin-3-ylethyl)tetrazol-5-amine
CID 63623261
N-(2-imidazol-1-ylethyl)-1-methyltetrazol-5-amine
CID 63150127
1-methyl-N-(3-methyl-2-propan-2-ylbutyl)tetrazol-5-amine
CID 102913752

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine?
The IUPAC name of N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine (CID 130727764) is N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine.
What is the SMILES notation for N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine?
The canonical SMILES for N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine is Cn1nnnc1NCCC1(F)CCC1.
What is the InChIKey of N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine?
The InChIKey is ANPCAUXCCOENHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN5/c1-14-7(11-12-13-14)10-6-5-8(9)3-2-4-8/h2-6H2,1H3,(H,10,11,13).
What are the key properties of N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine?
N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine has a molecular weight of 199.23 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine is sourced from PubChem (CID 130727764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).