5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide

C18H28N4O2 — CID 70765557

IUPAC5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide
SMILESO=C(N[C@H]1COC[C@@H]1N1CCCC1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C18H28N4O2/c23-18(14-10-19-21-17(14)13-6-2-1-3-7-13)20-15-11-24-12-16(15)22-8-4-5-9-22/h10,13,15-16H,1-9,11-12H2,(H,19,21)(H,20,23)/t15-,16-/m0/s1
InChIKeyQPEHBAUFPGUXND-HOTGVXAUSA-N
MW332.45 g/mol
LogP2.05
Rot. Bonds4

About 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide

5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide (PubChem CID 70765557) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide
PubChem CID70765557
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC Name5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide
SMILESO=C(N[C@H]1COC[C@@H]1N1CCCC1)c1cn[nH]c1C1CCCCC1
InChIInChI=1S/C18H28N4O2/c23-18(14-10-19-21-17(14)13-6-2-1-3-7-13)20-15-11-24-12-16(15)22-8-4-5-9-22/h10,13,15-16H,1-9,11-12H2,(H,19,21)(H,20,23)/t15-,16-/m0/s1
InChIKeyQPEHBAUFPGUXND-HOTGVXAUSA-N
XLogP2.05
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide (CID 70765557) is 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide is O=C(N[C@H]1COC[C@@H]1N1CCCC1)c1cn[nH]c1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide?
The InChIKey is QPEHBAUFPGUXND-HOTGVXAUSA-N. The full InChI is InChI=1S/C18H28N4O2/c23-18(14-10-19-21-17(14)13-6-2-1-3-7-13)20-15-11-24-12-16(15)22-8-4-5-9-22/h10,13,15-16H,1-9,11-12H2,(H,19,21)(H,20,23)/t15-,16-/m0/s1.
What are the key properties of 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide?
5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide has a molecular weight of 332.45 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 70765557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).