4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine

C10H17N3O — CID 164655672

IUPAC4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine
SMILESCc1cnn(C2CCC(C)OC2)c1N
InChIInChI=1S/C10H17N3O/c1-7-5-12-13(10(7)11)9-4-3-8(2)14-6-9/h5,8-9H,3-4,6,11H2,1-2H3
InChIKeyITDKZHFEQDGRSR-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.51
Rot. Bonds1

About 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine

4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine (PubChem CID 164655672) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine
PubChem CID164655672
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine
SMILESCc1cnn(C2CCC(C)OC2)c1N
InChIInChI=1S/C10H17N3O/c1-7-5-12-13(10(7)11)9-4-3-8(2)14-6-9/h5,8-9H,3-4,6,11H2,1-2H3
InChIKeyITDKZHFEQDGRSR-UHFFFAOYSA-N
XLogP1.51
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine?
The IUPAC name of 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine (CID 164655672) is 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine?
The canonical SMILES for 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine is Cc1cnn(C2CCC(C)OC2)c1N.
What is the InChIKey of 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine?
The InChIKey is ITDKZHFEQDGRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-5-12-13(10(7)11)9-4-3-8(2)14-6-9/h5,8-9H,3-4,6,11H2,1-2H3.
What are the key properties of 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine?
4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine has a molecular weight of 195.27 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(6-methyloxan-3-yl)pyrazol-5-amine is sourced from PubChem (CID 164655672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).