1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine

C10H18N4 — CID 83818500

IUPAC1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine
SMILESCn1cc(N)c(CCN2CCCC2)n1
InChIInChI=1S/C10H18N4/c1-13-8-9(11)10(12-13)4-7-14-5-2-3-6-14/h8H,2-7,11H2,1H3
InChIKeyQBYKWOSIRBEMOX-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.64
Rot. Bonds3

About 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine

1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine (PubChem CID 83818500) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine
PubChem CID83818500
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine
SMILESCn1cc(N)c(CCN2CCCC2)n1
InChIInChI=1S/C10H18N4/c1-13-8-9(11)10(12-13)4-7-14-5-2-3-6-14/h8H,2-7,11H2,1H3
InChIKeyQBYKWOSIRBEMOX-UHFFFAOYSA-N
XLogP0.64
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-Ethyl-1H-pyrazol-3-yl)ethan-1-amine
CID 17024749
1-(1-ethyl-1H-pyrazol-5-yl)ethan-1-amine
CID 19585894
1-methyl-3-(propan-2-yl)-1H-pyrazol-4-amine
CID 66009951
5-cyclopropyl-1-methyl-1H-pyrazol-4-amine
CID 66439808
3-methyl-1-(1-methylpiperidin-4-yl)-1H-pyrazol-4-amine
CID 69281646
1-(1-isopropyl-1H-pyrazol-3-yl)-ethylamine
CID 102550785
5-cyclopropyl-1-(propan-2-yl)-1H-pyrazol-4-amine
CID 19620129
5-Cyclopropyl-1-(1-methylpropyl)-1H-pyrazol-4-amine
CID 19620130
1-(1-Methylethyl)-1H-pyrazole-3-ethanamine
CID 53621927
2-(1-cyclopentyl-1H-pyrazol-3-yl)ethan-1-amine
CID 60136574
1-butyl-5-(propan-2-yl)-1H-pyrazol-4-amine
CID 66440829
1-butyl-5-ethyl-1H-pyrazol-4-amine
CID 66440830

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine?
The IUPAC name of 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine (CID 83818500) is 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine.
What is the SMILES notation for 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine?
The canonical SMILES for 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine is Cn1cc(N)c(CCN2CCCC2)n1.
What is the InChIKey of 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine?
The InChIKey is QBYKWOSIRBEMOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-13-8-9(11)10(12-13)4-7-14-5-2-3-6-14/h8H,2-7,11H2,1H3.
What are the key properties of 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine?
1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-pyrrolidin-1-ylethyl)pyrazol-4-amine is sourced from PubChem (CID 83818500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).