1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine

C10H17N7O — CID 114255580

IUPAC1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCNC(Cc1nnn(C)n1)c1cc(OC)n(C)n1
InChIInChI=1S/C10H17N7O/c1-11-7(5-9-12-15-17(3)14-9)8-6-10(18-4)16(2)13-8/h6-7,11H,5H2,1-4H3
InChIKeyJAZQRCQYDOWBSY-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.54
Rot. Bonds5

About 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine

1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 114255580) has the molecular formula C10H17N7O and a molecular weight of 251.29 g/mol. Its IUPAC name is 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID114255580
Molecular FormulaC10H17N7O
Molecular Weight251.29 g/mol
Exact Mass251.15
IUPAC Name1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCNC(Cc1nnn(C)n1)c1cc(OC)n(C)n1
InChIInChI=1S/C10H17N7O/c1-11-7(5-9-12-15-17(3)14-9)8-6-10(18-4)16(2)13-8/h6-7,11H,5H2,1-4H3
InChIKeyJAZQRCQYDOWBSY-UHFFFAOYSA-N
XLogP-0.54
TPSA82.68 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4,4,4-trifluoro-1-(5-methoxy-1-methylpyrazol-3-yl)-N-methylbutan-1-amine
CID 114255447
5,5,5-trifluoro-1-(5-methoxy-1-methylpyrazol-3-yl)-N-methylpentan-1-amine
CID 114255514
3-Methoxy-1-methyl-5-pyrrolidin-2-ylpyrazole
CID 82654621
1-(3-Methoxy-1-methyl-1h-pyrazol-5-yl)-n-methylethanamine
CID 89816521
1-(3,5-dimethylpyrazol-1-yl)-N-[(5-methoxy-1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]propan-2-amine
CID 53539629
2-(5-Methoxy-3-propylpyrazol-1-yl)ethanamine
CID 84718799
3-Ethyl-5-methoxy-1-pyrrolidin-3-ylpyrazole
CID 84720588
3-Cyclopropyl-5-methoxy-1-pyrrolidin-3-ylpyrazole
CID 84722424
3-Ethyl-5-methoxy-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 84722962
5-Methoxy-3-propyl-1-pyrrolidin-3-ylpyrazole
CID 84722964
3-Cyclopropyl-5-methoxy-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 84724816
2-[(3-Ethyl-5-methoxypyrazol-1-yl)methyl]piperidine
CID 84725324

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine (CID 114255580) is 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine is CNC(Cc1nnn(C)n1)c1cc(OC)n(C)n1.
What is the InChIKey of 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is JAZQRCQYDOWBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N7O/c1-11-7(5-9-12-15-17(3)14-9)8-6-10(18-4)16(2)13-8/h6-7,11H,5H2,1-4H3.
What are the key properties of 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine?
1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 251.29 g/mol, XLogP of -0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-1-methylpyrazol-3-yl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 114255580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).