1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine

C6H12N6 — CID 130942275

IUPAC1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine
SMILESCn1nnnc1NC1(C)CNC1
InChIInChI=1S/C6H12N6/c1-6(3-7-4-6)8-5-9-10-11-12(5)2/h7H,3-4H2,1-2H3,(H,8,9,11)
InChIKeyBHGQJAQLXNWLDB-UHFFFAOYSA-N
MW168.20 g/mol
LogP-1.02
Rot. Bonds2

About 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine

1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine (PubChem CID 130942275) has the molecular formula C6H12N6 and a molecular weight of 168.20 g/mol. Its IUPAC name is 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine
PubChem CID130942275
Molecular FormulaC6H12N6
Molecular Weight168.20 g/mol
Exact Mass168.11
IUPAC Name1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine
SMILESCn1nnnc1NC1(C)CNC1
InChIInChI=1S/C6H12N6/c1-6(3-7-4-6)8-5-9-10-11-12(5)2/h7H,3-4H2,1-2H3,(H,8,9,11)
InChIKeyBHGQJAQLXNWLDB-UHFFFAOYSA-N
XLogP-1.02
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[4-[(1-methyltetrazol-5-yl)amino]oxan-4-yl]methanol
CID 106299427
N-[1-(chloromethyl)-4-methylcyclohexyl]-1-methyltetrazol-5-amine
CID 65028310
N-(1-methyltetrazol-5-yl)piperidin-3-amine
CID 63320972
1-methyl-N-(2-methylcyclopropyl)tetrazol-5-amine
CID 63149797
N-[[1-(dimethylamino)cyclopropyl]methyl]-1-methyltetrazol-5-amine
CID 127017131
(1-methyltetrazol-5-yl)urea
CID 130674530
1-methyl-N-(2-pyrrolidin-3-ylethyl)tetrazol-5-amine
CID 63623261
2-[(1-methyltetrazol-5-yl)amino]ethanol
CID 63152176
2,6-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-1-amine
CID 83026797
N-[2-(1-fluorocyclobutyl)ethyl]-1-methyltetrazol-5-amine
CID 130727764
N-[[1-(chloromethyl)cyclopentyl]methyl]-1-methyltetrazol-5-amine
CID 115363664
N-(2,2-difluoroethyl)-1-methyltetrazol-5-amine
CID 79099576

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine?
The IUPAC name of 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine (CID 130942275) is 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine is Cn1nnnc1NC1(C)CNC1.
What is the InChIKey of 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine?
The InChIKey is BHGQJAQLXNWLDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N6/c1-6(3-7-4-6)8-5-9-10-11-12(5)2/h7H,3-4H2,1-2H3,(H,8,9,11).
What are the key properties of 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine?
1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine has a molecular weight of 168.20 g/mol, XLogP of -1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-methylazetidin-3-yl)tetrazol-5-amine is sourced from PubChem (CID 130942275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).