N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine

C9H19N5 — CID 103085322

IUPACN-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine
SMILESCCCC(C)n1nnnc1C(C)NC
InChIInChI=1S/C9H19N5/c1-5-6-7(2)14-9(8(3)10-4)11-12-13-14/h7-8,10H,5-6H2,1-4H3
InChIKeyBEVKOERFUCACHE-UHFFFAOYSA-N
MW197.29 g/mol
LogP1.31
Rot. Bonds5

About N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine

N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine (PubChem CID 103085322) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine
PubChem CID103085322
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC NameN-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine
SMILESCCCC(C)n1nnnc1C(C)NC
InChIInChI=1S/C9H19N5/c1-5-6-7(2)14-9(8(3)10-4)11-12-13-14/h7-8,10H,5-6H2,1-4H3
InChIKeyBEVKOERFUCACHE-UHFFFAOYSA-N
XLogP1.31
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-[1-(4-methylhexan-2-yl)tetrazol-5-yl]ethanamine
CID 103086438
N-ethyl-1-(1-heptan-2-yltetrazol-5-yl)ethanamine
CID 103085937
1-(1-hexan-2-yltetrazol-5-yl)-N-(2-methoxyethyl)ethanamine
CID 103085593
N-ethyl-1-(1-hexan-3-yltetrazol-5-yl)ethanamine
CID 103085598
N-[1-[1-(1-cyclopropylpropan-2-yl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103086242
N-[1-[1-(1-methylsulfinylpropan-2-yl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103086942
1-(1-hexyltetrazol-5-yl)-N-methylethanamine
CID 103086260
N-[1-[1-(1-ethoxypropan-2-yl)tetrazol-5-yl]ethyl]-2-methylpropan-1-amine
CID 103085783
1-(3,5-diethyl-1-pentan-2-ylpyrazol-4-yl)-N-methylethanamine
CID 107887130
N-methyl-1-[1-(7-methyloctyl)tetrazol-5-yl]ethanamine
CID 107818243
N-[1-[1-(1-cyclopropylethyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103085495
N-[1-[1-(dicyclopropylmethyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103085944

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine?
The IUPAC name of N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine (CID 103085322) is N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine?
The canonical SMILES for N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine is CCCC(C)n1nnnc1C(C)NC.
What is the InChIKey of N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine?
The InChIKey is BEVKOERFUCACHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5/c1-5-6-7(2)14-9(8(3)10-4)11-12-13-14/h7-8,10H,5-6H2,1-4H3.
What are the key properties of N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine?
N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine has a molecular weight of 197.29 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-pentan-2-yltetrazol-5-yl)ethanamine is sourced from PubChem (CID 103085322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).