1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole

C10H17N3O — CID 82870045

IUPAC1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
SMILESCn1ccc(COCC2CCNC2)n1
InChIInChI=1S/C10H17N3O/c1-13-5-3-10(12-13)8-14-7-9-2-4-11-6-9/h3,5,9,11H,2,4,6-8H2,1H3
InChIKeyUMYNAJWRIUTLFK-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.55
Rot. Bonds4

About 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole

1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole (PubChem CID 82870045) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole.

Molecular Properties

Compound Name1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
PubChem CID82870045
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
SMILESCn1ccc(COCC2CCNC2)n1
InChIInChI=1S/C10H17N3O/c1-13-5-3-10(12-13)8-14-7-9-2-4-11-6-9/h3,5,9,11H,2,4,6-8H2,1H3
InChIKeyUMYNAJWRIUTLFK-UHFFFAOYSA-N
XLogP0.55
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 64783422
1-methyl-4-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 62371587
2-(pyrrolidin-3-ylmethoxymethyl)quinoline
CID 46941556
(3R)-3-(phenylmethoxymethyl)pyrrolidine
CID 26192483
N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine
CID 82881493
3-[(4-iodophenyl)methoxymethyl]pyrrolidine
CID 56830526
2-(pyrrolidin-3-ylmethoxymethyl)pyrimidine
CID 62698828
1-phenyl-3-(2-pyrrolidin-3-ylethoxymethyl)pyrazole
CID 114796055
(3R)-3-[(4-methoxyphenyl)methoxymethyl]pyrrolidine
CID 86321821
3-[(2-methylphenyl)methoxymethyl]pyrrolidine
CID 56829929
2-propan-2-yl-4-(pyrrolidin-3-ylmethoxymethyl)-1,3-thiazole
CID 62372289
3-(butoxymethyl)-1-methylpyrazole
CID 122170488

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole?
The IUPAC name of 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole (CID 82870045) is 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole.
What is the SMILES notation for 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole?
The canonical SMILES for 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole is Cn1ccc(COCC2CCNC2)n1.
What is the InChIKey of 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole?
The InChIKey is UMYNAJWRIUTLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-5-3-10(12-13)8-14-7-9-2-4-11-6-9/h3,5,9,11H,2,4,6-8H2,1H3.
What are the key properties of 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole?
1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole has a molecular weight of 195.27 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole is sourced from PubChem (CID 82870045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).