1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole

C10H17N3O — CID 103004028

IUPAC1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole
SMILESCn1cc(CCOC2CCNC2)cn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(6-12-13)3-5-14-10-2-4-11-7-10/h6,8,10-11H,2-5,7H2,1H3
InChIKeyAOAOMCYZXNTMBL-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.34
Rot. Bonds4

About 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole

1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole (PubChem CID 103004028) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole.

Molecular Properties

Compound Name1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole
PubChem CID103004028
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole
SMILESCn1cc(CCOC2CCNC2)cn1
InChIInChI=1S/C10H17N3O/c1-13-8-9(6-12-13)3-5-14-10-2-4-11-7-10/h6,8,10-11H,2-5,7H2,1H3
InChIKeyAOAOMCYZXNTMBL-UHFFFAOYSA-N
XLogP0.34
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 ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-pyrrolidin-3-yloxyethyl)pyridine
CID 62328437
3-[2-(4-fluorophenyl)ethoxy]pyrrolidine
CID 115070535
N-[2-(1-methylpyrazol-4-yl)ethyl]-2-piperidin-4-yloxyacetamide
CID 80682195
3-(1-methylpyrazol-4-yl)-1-pyrrolidin-3-ylpropan-1-one
CID 103023696
2-[2-(1-methylpyrazol-4-yl)ethoxy]cyclopentan-1-amine
CID 103004175
1-methyl-4-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 62371587
1-(1-methylpyrazol-4-yl)-3-piperidin-4-yloxypropan-2-one
CID 116571131
1-[(1S,6R)-3,9-diazabicyclo[4.2.1]nonan-9-yl]-3-(1-methylpyrazol-4-yl)propan-1-one
CID 74237642
4-[1-fluoro-3-(1-methylpyrazol-4-yl)propyl]piperidine
CID 103023162
3-[2-(3-fluorophenyl)ethoxy]pyrrolidine
CID 115070515
3-(1-methylpyrazol-4-yl)-N-propyl-N-pyrrolidin-3-ylpropanamide;dihydrochloride
CID 119532209
3-(1-methylpyrazol-4-yl)-N-piperidin-3-ylpropanamide;dihydrochloride
CID 119427806

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole?
The IUPAC name of 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole (CID 103004028) is 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole.
What is the SMILES notation for 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole?
The canonical SMILES for 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole is Cn1cc(CCOC2CCNC2)cn1.
What is the InChIKey of 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole?
The InChIKey is AOAOMCYZXNTMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8-9(6-12-13)3-5-14-10-2-4-11-7-10/h6,8,10-11H,2-5,7H2,1H3.
What are the key properties of 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole?
1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole has a molecular weight of 195.27 g/mol, XLogP of 0.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-pyrrolidin-3-yloxyethyl)pyrazole is sourced from PubChem (CID 103004028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).