2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol

C14H19N5O — CID 133376008

IUPAC2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol
SMILESOCCC1(CNc2nnnn2-c2ccccc2)CCC1
InChIInChI=1S/C14H19N5O/c20-10-9-14(7-4-8-14)11-15-13-16-17-18-19(13)12-5-2-1-3-6-12/h1-3,5-6,20H,4,7-11H2,(H,15,16,18)
InChIKeyXSLJGIGCEFTISR-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.63
Rot. Bonds6

About 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol

2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol (PubChem CID 133376008) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol.

Molecular Properties

Compound Name2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol
PubChem CID133376008
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol
SMILESOCCC1(CNc2nnnn2-c2ccccc2)CCC1
InChIInChI=1S/C14H19N5O/c20-10-9-14(7-4-8-14)11-15-13-16-17-18-19(13)12-5-2-1-3-6-12/h1-3,5-6,20H,4,7-11H2,(H,15,16,18)
InChIKeyXSLJGIGCEFTISR-UHFFFAOYSA-N
XLogP1.63
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-methylcyclobutyl)methyl]-1-phenyltetrazol-5-amine
CID 103736960
N-[[1-(dimethylamino)cycloheptyl]methyl]-1-phenyltetrazol-5-amine
CID 17418964
N-[(4-methoxyoxan-4-yl)methyl]-1-phenyltetrazol-5-amine
CID 133400034
2-(hydroxymethyl)-2-[(1-phenyltetrazol-5-yl)amino]propane-1,3-diol
CID 107849570
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-phenyltetrazol-5-amine
CID 133459238
2-[1-[(1-phenyltetrazol-5-yl)amino]cyclopentyl]acetic acid
CID 64700964
N-[(2-aminocyclohexyl)methyl]-1-phenyltetrazol-5-amine
CID 64927678
methyl 3-[(1-phenyltetrazol-5-yl)amino]propanoate
CID 60631997
N'-(1-phenyltetrazol-5-yl)propane-1,3-diamine
CID 24707793
N-[(3-aminocyclobutyl)methyl]-1-phenyltetrazol-5-amine
CID 66007158
2-[(1-phenyltetrazol-5-yl)amino]butan-1-ol
CID 43388771
1-[[(1-phenyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
CID 65108941

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol?
The IUPAC name of 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol (CID 133376008) is 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol.
What is the SMILES notation for 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol?
The canonical SMILES for 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol is OCCC1(CNc2nnnn2-c2ccccc2)CCC1.
What is the InChIKey of 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol?
The InChIKey is XSLJGIGCEFTISR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c20-10-9-14(7-4-8-14)11-15-13-16-17-18-19(13)12-5-2-1-3-6-12/h1-3,5-6,20H,4,7-11H2,(H,15,16,18).
What are the key properties of 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol?
2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol has a molecular weight of 273.34 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(1-phenyltetrazol-5-yl)amino]methyl]cyclobutyl]ethanol is sourced from PubChem (CID 133376008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).