N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine

C8H15N5O — CID 62737642

IUPACN-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine
SMILESCNCc1nnnn1C1CCOCC1
InChIInChI=1S/C8H15N5O/c1-9-6-8-10-11-12-13(8)7-2-4-14-5-3-7/h7,9H,2-6H2,1H3
InChIKeyWWCLQOWINPGFFQ-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.26
Rot. Bonds3

About N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine

N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine (PubChem CID 62737642) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine
PubChem CID62737642
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC NameN-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine
SMILESCNCc1nnnn1C1CCOCC1
InChIInChI=1S/C8H15N5O/c1-9-6-8-10-11-12-13(8)7-2-4-14-5-3-7/h7,9H,2-6H2,1H3
InChIKeyWWCLQOWINPGFFQ-UHFFFAOYSA-N
XLogP-0.26
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[1-(oxolan-3-yl)tetrazol-5-yl]methyl]propan-2-amine
CID 80715224
N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine
CID 115892141
N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine
CID 103085524
N-[[1-(2-methyloxan-4-yl)tetrazol-5-yl]methyl]cyclopropanamine
CID 114109347
1-[1-(3-ethyl-2-methylcyclopentyl)tetrazol-5-yl]-N-methylmethanamine
CID 64914472
4-[[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-4-yl]methyl]morpholine
CID 47053718
4-[(1-piperidin-4-yltetrazol-5-yl)methyl]morpholine
CID 84759260
N-[(1-cyclopentyltetrazol-5-yl)methyl]propanamide
CID 30295250
2-methyl-N-[[1-(4-propylcyclohexyl)tetrazol-5-yl]methyl]propan-2-amine
CID 62761526
1-[1-(cyclobutylmethyl)tetrazol-5-yl]-N-methylmethanamine
CID 62735754
4-bromo-5-methyl-1-(oxan-4-yl)triazole
CID 171647649
1-[1-[(1-cyclopropyltetrazol-5-yl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 81490901

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine (CID 62737642) is N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine is CNCc1nnnn1C1CCOCC1.
What is the InChIKey of N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine?
The InChIKey is WWCLQOWINPGFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c1-9-6-8-10-11-12-13(8)7-2-4-14-5-3-7/h7,9H,2-6H2,1H3.
What are the key properties of N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine?
N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine has a molecular weight of 197.24 g/mol, XLogP of -0.26, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine is sourced from PubChem (CID 62737642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).