6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline

C19H22N4 — CID 25156751

IUPAC6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline
SMILESC[C@@H]1CCCN1CCc1ccc2nc(-c3cn[nH]c3)ccc2c1
InChIInChI=1S/C19H22N4/c1-14-3-2-9-23(14)10-8-15-4-6-18-16(11-15)5-7-19(22-18)17-12-20-21-13-17/h4-7,11-14H,2-3,8-10H2,1H3,(H,20,21)/t14-/m1/s1
InChIKeyCBYMJXSYCPSHQC-CQSZACIVSA-N
MW306.41 g/mol
LogP3.65
Rot. Bonds4

About 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline

6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline (PubChem CID 25156751) has the molecular formula C19H22N4 and a molecular weight of 306.41 g/mol. Its IUPAC name is 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline.

Molecular Properties

Compound Name6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline
PubChem CID25156751
Molecular FormulaC19H22N4
Molecular Weight306.41 g/mol
Exact Mass306.18
IUPAC Name6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline
SMILESC[C@@H]1CCCN1CCc1ccc2nc(-c3cn[nH]c3)ccc2c1
InChIInChI=1S/C19H22N4/c1-14-3-2-9-23(14)10-8-15-4-6-18-16(11-15)5-7-19(22-18)17-12-20-21-13-17/h4-7,11-14H,2-3,8-10H2,1H3,(H,20,21)/t14-/m1/s1
InChIKeyCBYMJXSYCPSHQC-CQSZACIVSA-N
XLogP3.65
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline 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 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline?
The IUPAC name of 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline (CID 25156751) is 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline.
What is the SMILES notation for 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline?
The canonical SMILES for 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline is C[C@@H]1CCCN1CCc1ccc2nc(-c3cn[nH]c3)ccc2c1.
What is the InChIKey of 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline?
The InChIKey is CBYMJXSYCPSHQC-CQSZACIVSA-N. The full InChI is InChI=1S/C19H22N4/c1-14-3-2-9-23(14)10-8-15-4-6-18-16(11-15)5-7-19(22-18)17-12-20-21-13-17/h4-7,11-14H,2-3,8-10H2,1H3,(H,20,21)/t14-/m1/s1.
What are the key properties of 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline?
6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline has a molecular weight of 306.41 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-(1H-pyrazol-4-yl)quinoline is sourced from PubChem (CID 25156751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).