N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine

C20H18N4 — CID 133327159

IUPACN-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine
SMILESCC(Nc1ccc2ccccc2n1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C20H18N4/c1-15(16-7-10-18(11-8-16)24-14-4-13-21-24)22-20-12-9-17-5-2-3-6-19(17)23-20/h2-15H,1H3,(H,22,23)
InChIKeyJBEAAQCCVWIXRZ-UHFFFAOYSA-N
MW314.39 g/mol
LogP4.59
Rot. Bonds4

About N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine

N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine (PubChem CID 133327159) has the molecular formula C20H18N4 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine.

Molecular Properties

Compound NameN-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine
PubChem CID133327159
Molecular FormulaC20H18N4
Molecular Weight314.39 g/mol
Exact Mass314.15
IUPAC NameN-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine
SMILESCC(Nc1ccc2ccccc2n1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C20H18N4/c1-15(16-7-10-18(11-8-16)24-14-4-13-21-24)22-20-12-9-17-5-2-3-6-19(17)23-20/h2-15H,1H3,(H,22,23)
InChIKeyJBEAAQCCVWIXRZ-UHFFFAOYSA-N
XLogP4.59
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-pyrazol-1-ylphenyl)ethyl]pyridin-2-amine
CID 133327058
N-[1-(4-chlorophenyl)ethyl]quinolin-2-amine
CID 60644870
N-[1-(4-pyrazol-1-ylphenyl)ethyl]pyrimidin-2-amine
CID 133327133
N-(1-pyrazol-1-ylpropan-2-yl)quinolin-2-amine
CID 61462720
N-[1-(5-methylfuran-2-yl)ethyl]quinolin-2-amine
CID 60651617
2,4-dimethyl-N-[(1S)-1-(4-pyrazol-1-ylphenyl)ethyl]quinoline-3-carboxamide
CID 124882388
N-prop-2-ynyl-6-[1-(4-pyrazol-1-ylphenyl)ethylamino]pyridine-3-carboxamide
CID 133327135
3-amino-2-methyl-N-[1-(4-pyrazol-1-ylphenyl)ethyl]butanamide
CID 120501837
N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]quinolin-2-amine
CID 63090359
N-[bis(phosphanyl)methyl]quinolin-2-amine
CID 118465830
N-[1-(4-pyrazol-1-ylphenyl)ethyl]-[1]benzofuro[3,2-d]pyrimidin-4-amine
CID 133327160
6-tert-butyl-N-[1-(4-pyrazol-1-ylphenyl)ethyl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 133327141

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine?
The IUPAC name of N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine (CID 133327159) is N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine.
What is the SMILES notation for N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine?
The canonical SMILES for N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine is CC(Nc1ccc2ccccc2n1)c1ccc(-n2cccn2)cc1.
What is the InChIKey of N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine?
The InChIKey is JBEAAQCCVWIXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4/c1-15(16-7-10-18(11-8-16)24-14-4-13-21-24)22-20-12-9-17-5-2-3-6-19(17)23-20/h2-15H,1H3,(H,22,23).
What are the key properties of N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine?
N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine has a molecular weight of 314.39 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-pyrazol-1-ylphenyl)ethyl]quinolin-2-amine is sourced from PubChem (CID 133327159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).