4-methyl-1-pyrrolidin-3-ylpyrazole

C8H13N3 — CID 62329635

IUPAC4-methyl-1-pyrrolidin-3-ylpyrazole
SMILESCc1cnn(C2CCNC2)c1
InChIInChI=1S/C8H13N3/c1-7-4-10-11(6-7)8-2-3-9-5-8/h4,6,8-9H,2-3,5H2,1H3
InChIKeyNXDPGCYRUPUNMK-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.73
Rot. Bonds1

About 4-methyl-1-pyrrolidin-3-ylpyrazole

4-methyl-1-pyrrolidin-3-ylpyrazole (PubChem CID 62329635) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-methyl-1-pyrrolidin-3-ylpyrazole.

Molecular Properties

Compound Name4-methyl-1-pyrrolidin-3-ylpyrazole
PubChem CID62329635
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name4-methyl-1-pyrrolidin-3-ylpyrazole
SMILESCc1cnn(C2CCNC2)c1
InChIInChI=1S/C8H13N3/c1-7-4-10-11(6-7)8-2-3-9-5-8/h4,6,8-9H,2-3,5H2,1H3
InChIKeyNXDPGCYRUPUNMK-UHFFFAOYSA-N
XLogP0.73
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-((1-Methyl-1H-pyrazol-4-yl)methyl)piperazine
CID 7022272
3-(4-methyl-1H-pyrazol-1-yl)piperidine
CID 54592641
(1-ethyl-1H-pyrazol-4-yl)methanamine
CID 580103
(1-methyl-1H-pyrazol-4-yl)methanamine
CID 671225
1-(pyrrolidin-2-ylmethyl)-1H-pyrazole
CID 25220770
((1-ethyl-1H-pyrazol-4-yl)methyl)(methyl)amine
CID 672401
1-methyl-4-(pyrrolidin-2-yl)-1H-pyrazole
CID 25248267
N-methyl-1-(1-methyl-1H-pyrazol-4-yl)methanamine
CID 565445
ethyl[(1-ethyl-1H-pyrazol-4-yl)methyl]amine
CID 16394860
4-chloro-1-(pyrrolidin-3-yl)-1H-pyrazole
CID 62329636
3-(4-methyl-1H-pyrazol-1-yl)propan-1-amine
CID 4715092
2-(4-Methyl-1H-pyrazol-1-yl)ethan-1-amine
CID 19616598

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-pyrrolidin-3-ylpyrazole?
The IUPAC name of 4-methyl-1-pyrrolidin-3-ylpyrazole (CID 62329635) is 4-methyl-1-pyrrolidin-3-ylpyrazole.
What is the SMILES notation for 4-methyl-1-pyrrolidin-3-ylpyrazole?
The canonical SMILES for 4-methyl-1-pyrrolidin-3-ylpyrazole is Cc1cnn(C2CCNC2)c1.
What is the InChIKey of 4-methyl-1-pyrrolidin-3-ylpyrazole?
The InChIKey is NXDPGCYRUPUNMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-7-4-10-11(6-7)8-2-3-9-5-8/h4,6,8-9H,2-3,5H2,1H3.
What are the key properties of 4-methyl-1-pyrrolidin-3-ylpyrazole?
4-methyl-1-pyrrolidin-3-ylpyrazole has a molecular weight of 151.21 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-pyrrolidin-3-ylpyrazole is sourced from PubChem (CID 62329635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).