[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine

C7H13N5 — CID 127004616

IUPAC[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine
SMILESCn1nnc(C2CCC2CN)n1
InChIInChI=1S/C7H13N5/c1-12-10-7(9-11-12)6-3-2-5(6)4-8/h5-6H,2-4,8H2,1H3
InChIKeyJGQMBDFZUIHJKF-UHFFFAOYSA-N
MW167.22 g/mol
LogP-0.34
Rot. Bonds2

About [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine

[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine (PubChem CID 127004616) has the molecular formula C7H13N5 and a molecular weight of 167.22 g/mol. Its IUPAC name is [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine
PubChem CID127004616
Molecular FormulaC7H13N5
Molecular Weight167.22 g/mol
Exact Mass167.12
IUPAC Name[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine
SMILESCn1nnc(C2CCC2CN)n1
InChIInChI=1S/C7H13N5/c1-12-10-7(9-11-12)6-3-2-5(6)4-8/h5-6H,2-4,8H2,1H3
InChIKeyJGQMBDFZUIHJKF-UHFFFAOYSA-N
XLogP-0.34
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.22
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-3-(2-methyltetrazol-5-yl)cyclohexan-1-one
CID 165496636
2-(2-methyltetrazol-5-yl)cyclopentane-1-carbonitrile
CID 54328238
5-(3H-diazirin-3-yl)-2-methyltetrazole
CID 131865476
[2-(1-methyltetrazol-5-yl)cyclohexyl]methanamine
CID 164650237
3-(2-methyltetrazol-5-yl)cyclobutan-1-ol
CID 177227904
2-methyl-5-pyrrolidin-2-yltetrazole;hydrochloride
CID 155895364
2-cyclopropyl-2-methyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107053537
[2-(1-propylpyrazol-4-yl)cyclobutyl]methanamine
CID 81009628
(6R)-6-(2-methyltetrazol-5-yl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
CID 58812241
5-(5-bromo-2,2-dimethylcyclohexyl)-2-methyltetrazole
CID 165491441
5-[2-(aminomethyl)cyclohexyl]-N,4-dimethyl-1,2,4-triazol-3-amine
CID 112597244
3-methyl-5-(2-methyltetrazol-5-yl)piperidine
CID 130993639

Frequently Asked Questions

What is the IUPAC name of [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine?
The IUPAC name of [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine (CID 127004616) is [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine.
What is the SMILES notation for [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine?
The canonical SMILES for [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine is Cn1nnc(C2CCC2CN)n1.
What is the InChIKey of [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine?
The InChIKey is JGQMBDFZUIHJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5/c1-12-10-7(9-11-12)6-3-2-5(6)4-8/h5-6H,2-4,8H2,1H3.
What are the key properties of [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine?
[2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine has a molecular weight of 167.22 g/mol, XLogP of -0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methyltetrazol-5-yl)cyclobutyl]methanamine is sourced from PubChem (CID 127004616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).