N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine

C10H17N3O — CID 65330463

IUPACN-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine
SMILESCNC(c1ccnn1C)C1CCOC1
InChIInChI=1S/C10H17N3O/c1-11-10(8-4-6-14-7-8)9-3-5-12-13(9)2/h3,5,8,10-11H,4,6-7H2,1-2H3
InChIKeyBMJNEWAEUYIUAI-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.72
Rot. Bonds3

About N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine

N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine (PubChem CID 65330463) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine
PubChem CID65330463
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine
SMILESCNC(c1ccnn1C)C1CCOC1
InChIInChI=1S/C10H17N3O/c1-11-10(8-4-6-14-7-8)9-3-5-12-13(9)2/h3,5,8,10-11H,4,6-7H2,1-2H3
InChIKeyBMJNEWAEUYIUAI-UHFFFAOYSA-N
XLogP0.72
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(2-methylpyrazol-3-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105229276
(2-methylpyrazol-3-yl)-(oxolan-3-yl)methanamine
CID 65330620
1-(1,4-dioxan-2-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 65352324
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 105147665
N-methyl-1-(2-methylpyrazol-3-yl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105148778
1-(1,1-dioxothiolan-3-yl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115336746
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115858379
(2-methylpyrazol-3-yl)-(oxan-4-yl)methanol
CID 63960737
N-methyl-1-(oxolan-3-yl)-1-(1-phenylpyrazol-4-yl)methanamine
CID 61276580
[(2-methylpyrazol-3-yl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322157
2-cyclopentyl-N-methyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 115858828
[cyclopentyl-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105204250

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine (CID 65330463) is N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine is CNC(c1ccnn1C)C1CCOC1.
What is the InChIKey of N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine?
The InChIKey is BMJNEWAEUYIUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-11-10(8-4-6-14-7-8)9-3-5-12-13(9)2/h3,5,8,10-11H,4,6-7H2,1-2H3.
What are the key properties of N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine?
N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine has a molecular weight of 195.27 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylpyrazol-3-yl)-1-(oxolan-3-yl)methanamine is sourced from PubChem (CID 65330463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).