N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine

C10H19N5O — CID 107166975

IUPACN-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine
SMILESCn1nnc(CNCC2(C)CCOCC2)n1
InChIInChI=1S/C10H19N5O/c1-10(3-5-16-6-4-10)8-11-7-9-12-14-15(2)13-9/h11H,3-8H2,1-2H3
InChIKeyRUMIDSWMBSXPLN-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.12
Rot. Bonds4

About N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine

N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine (PubChem CID 107166975) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine.

Molecular Properties

Compound NameN-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine
PubChem CID107166975
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC NameN-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine
SMILESCn1nnc(CNCC2(C)CCOCC2)n1
InChIInChI=1S/C10H19N5O/c1-10(3-5-16-6-4-10)8-11-7-9-12-14-15(2)13-9/h11H,3-8H2,1-2H3
InChIKeyRUMIDSWMBSXPLN-UHFFFAOYSA-N
XLogP0.12
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(3-methoxyoxolan-3-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine
CID 107042678
1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
CID 107042475
[4-[(2-methyltetrazol-5-yl)methylamino]oxan-4-yl]methanol
CID 106297503
N-[(4-methyloxan-4-yl)methyl]-1-(5-methyl-1H-1,2,4-triazol-3-yl)methanamine
CID 104586687
4-[(2-methyltetrazol-5-yl)methyl]oxan-4-ol
CID 107045762
2-methoxy-N-[[4-[(2-methyltetrazol-5-yl)methyl]oxan-4-yl]methyl]ethanamine
CID 107053257
4-[(2-methyltetrazol-5-yl)methyl]oxepan-4-amine
CID 107046738
N-[(4-methyloxan-4-yl)methyl]-1-(1H-pyrrol-3-yl)methanamine
CID 115686396
1-(4-ethoxyoxan-4-yl)-N-ethyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051149
1-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(4-methyloxan-4-yl)methyl]methanamine
CID 103743670
3-methyl-1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclohexan-1-ol
CID 107042478
N-[[3-[(2-methyltetrazol-5-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 107053238

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine?
The IUPAC name of N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine (CID 107166975) is N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine.
What is the SMILES notation for N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine?
The canonical SMILES for N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine is Cn1nnc(CNCC2(C)CCOCC2)n1.
What is the InChIKey of N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine?
The InChIKey is RUMIDSWMBSXPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-10(3-5-16-6-4-10)8-11-7-9-12-14-15(2)13-9/h11H,3-8H2,1-2H3.
What are the key properties of N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine?
N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine has a molecular weight of 225.30 g/mol, XLogP of 0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyloxan-4-yl)methyl]-1-(2-methyltetrazol-5-yl)methanamine is sourced from PubChem (CID 107166975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).