1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole

C11H19N3 — CID 114557866

IUPAC1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole
SMILESCCCn1nccc1CC1CCNC1
InChIInChI=1S/C11H19N3/c1-2-7-14-11(4-6-13-14)8-10-3-5-12-9-10/h4,6,10,12H,2-3,5,7-9H2,1H3
InChIKeyKYOYPSKHXMTAKM-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.45
Rot. Bonds4

About 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole

1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole (PubChem CID 114557866) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole.

Molecular Properties

Compound Name1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole
PubChem CID114557866
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole
SMILESCCCn1nccc1CC1CCNC1
InChIInChI=1S/C11H19N3/c1-2-7-14-11(4-6-13-14)8-10-3-5-12-9-10/h4,6,10,12H,2-3,5,7-9H2,1H3
InChIKeyKYOYPSKHXMTAKM-UHFFFAOYSA-N
XLogP1.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclobutylmethyl)-5-(pyrrolidin-3-ylmethyl)pyrazole
CID 84685100
2-(2-propylpyrazol-3-yl)-5-[[(3R)-pyrrolidin-3-yl]methyl]pyrazine
CID 124942689
4-[[2-(3-methoxypropyl)pyrazol-3-yl]methyl]piperidine
CID 114278042
N-(piperidin-4-ylmethyl)-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
CID 114556404
N-propyl-N-[(2-propylpyrazol-3-yl)methyl]piperidin-3-amine
CID 114556340
2-[[(3S)-piperidin-3-yl]methyl]-5-(2-propylpyrazol-3-yl)pyrazine
CID 124976993
4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555631
4-(piperidin-4-ylmethyl)-2-(2-propylpyrazol-3-yl)pyridine
CID 110102012
4-propyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555646
1-(piperidin-3-ylmethyl)-4-(2-propylpyrazol-3-yl)piperidine;hydrochloride
CID 120849907
2-methyl-N-(2-pyrrolidin-3-ylethyl)pyrazol-3-amine
CID 103542541
N-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-3-amine
CID 79740865

Frequently Asked Questions

What is the IUPAC name of 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole?
The IUPAC name of 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole (CID 114557866) is 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole.
What is the SMILES notation for 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole?
The canonical SMILES for 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole is CCCn1nccc1CC1CCNC1.
What is the InChIKey of 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole?
The InChIKey is KYOYPSKHXMTAKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-2-7-14-11(4-6-13-14)8-10-3-5-12-9-10/h4,6,10,12H,2-3,5,7-9H2,1H3.
What are the key properties of 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole?
1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole has a molecular weight of 193.29 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-5-(pyrrolidin-3-ylmethyl)pyrazole is sourced from PubChem (CID 114557866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).