1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine

C8H14FN5 — CID 131062453

IUPAC1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCn1nnc(CC(N)C2(C)CC2F)n1
InChIInChI=1S/C8H14FN5/c1-8(4-5(8)9)6(10)3-7-11-13-14(2)12-7/h5-6H,3-4,10H2,1-2H3
InChIKeyHIXDFIXSFNZZFT-UHFFFAOYSA-N
MW199.23 g/mol
LogP-0.17
Rot. Bonds3

About 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine

1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 131062453) has the molecular formula C8H14FN5 and a molecular weight of 199.23 g/mol. Its IUPAC name is 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID131062453
Molecular FormulaC8H14FN5
Molecular Weight199.23 g/mol
Exact Mass199.12
IUPAC Name1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCn1nnc(CC(N)C2(C)CC2F)n1
InChIInChI=1S/C8H14FN5/c1-8(4-5(8)9)6(10)3-7-11-13-14(2)12-7/h5-6H,3-4,10H2,1-2H3
InChIKeyHIXDFIXSFNZZFT-UHFFFAOYSA-N
XLogP-0.17
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methyloxolan-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050310
1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050394
1-(1-adamantyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107064859
1-cyclobutyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107049334
1-(1-ethoxycyclohexyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051124
1-cyclohexyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048433
[1-(3-methyl-1-adamantyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066824
2-(2-methyltetrazol-5-yl)-1-(oxolan-2-yl)ethanamine
CID 107049445
[3-[(2-methyltetrazol-5-yl)methyl]-3-bicyclo[3.1.0]hexanyl]methanamine
CID 107053508
1,1-diethoxy-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050132
N-methyl-2-(2-methyltetrazol-5-yl)-1-(2-methylthiolan-2-yl)ethanamine
CID 107065238
1-(1-methoxycyclobutyl)-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107065522

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine (CID 131062453) is 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine is Cn1nnc(CC(N)C2(C)CC2F)n1.
What is the InChIKey of 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is HIXDFIXSFNZZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN5/c1-8(4-5(8)9)6(10)3-7-11-13-14(2)12-7/h5-6H,3-4,10H2,1-2H3.
What are the key properties of 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine?
1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 199.23 g/mol, XLogP of -0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-1-methylcyclopropyl)-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 131062453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).