N-(1-phenylpyrazol-4-yl)quinolin-8-amine

C18H14N4 — CID 82536218

IUPACN-(1-phenylpyrazol-4-yl)quinolin-8-amine
SMILESc1ccc(-n2cc(Nc3cccc4cccnc34)cn2)cc1
InChIInChI=1S/C18H14N4/c1-2-8-16(9-3-1)22-13-15(12-20-22)21-17-10-4-6-14-7-5-11-19-18(14)17/h1-13,21H
InChIKeyPNINOACDIISPLP-UHFFFAOYSA-N
MW286.34 g/mol
LogP4.16
Rot. Bonds3

About N-(1-phenylpyrazol-4-yl)quinolin-8-amine

N-(1-phenylpyrazol-4-yl)quinolin-8-amine (PubChem CID 82536218) has the molecular formula C18H14N4 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-(1-phenylpyrazol-4-yl)quinolin-8-amine.

Molecular Properties

Compound NameN-(1-phenylpyrazol-4-yl)quinolin-8-amine
PubChem CID82536218
Molecular FormulaC18H14N4
Molecular Weight286.34 g/mol
Exact Mass286.12
IUPAC NameN-(1-phenylpyrazol-4-yl)quinolin-8-amine
SMILESc1ccc(-n2cc(Nc3cccc4cccnc34)cn2)cc1
InChIInChI=1S/C18H14N4/c1-2-8-16(9-3-1)22-13-15(12-20-22)21-17-10-4-6-14-7-5-11-19-18(14)17/h1-13,21H
InChIKeyPNINOACDIISPLP-UHFFFAOYSA-N
XLogP4.16
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyridin-2-ylquinolin-8-amine
CID 82537542
N-(4-fluorophenyl)-1-phenylpyrazol-4-amine
CID 82537198
5-(quinolin-8-ylamino)pyridine-3-carboxylic acid
CID 82535032
N-phenylsulfanylquinolin-8-amine
CID 123285595
2-(quinolin-8-ylamino)benzonitrile
CID 28601412
N-quinolin-8-ylhydroxylamine
CID 22011433
N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine
CID 177207812
N-[2-[2-(aminomethyl)phenyl]phenyl]quinolin-8-amine
CID 174947176
2-methyl-N-[1-(1-phenylpyrazol-4-yl)ethyl]pyridin-3-amine
CID 81473456
methyl N-[4-(quinolin-8-ylamino)phenyl]carbamate
CID 112989327
N-[(Z)-naphthalen-2-ylmethylideneamino]quinolin-8-amine
CID 7721506
N-[(E)-[(2E)-2-(quinolin-8-ylhydrazinylidene)ethylidene]amino]quinolin-8-amine
CID 6870658

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpyrazol-4-yl)quinolin-8-amine?
The IUPAC name of N-(1-phenylpyrazol-4-yl)quinolin-8-amine (CID 82536218) is N-(1-phenylpyrazol-4-yl)quinolin-8-amine.
What is the SMILES notation for N-(1-phenylpyrazol-4-yl)quinolin-8-amine?
The canonical SMILES for N-(1-phenylpyrazol-4-yl)quinolin-8-amine is c1ccc(-n2cc(Nc3cccc4cccnc34)cn2)cc1.
What is the InChIKey of N-(1-phenylpyrazol-4-yl)quinolin-8-amine?
The InChIKey is PNINOACDIISPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4/c1-2-8-16(9-3-1)22-13-15(12-20-22)21-17-10-4-6-14-7-5-11-19-18(14)17/h1-13,21H.
What are the key properties of N-(1-phenylpyrazol-4-yl)quinolin-8-amine?
N-(1-phenylpyrazol-4-yl)quinolin-8-amine has a molecular weight of 286.34 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpyrazol-4-yl)quinolin-8-amine is sourced from PubChem (CID 82536218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).