N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine

C14H14N4 — CID 55097402

IUPACN-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine
SMILESCC(Nc1ccc2ncccc2c1)c1ccn[nH]1
InChIInChI=1S/C14H14N4/c1-10(13-6-8-16-18-13)17-12-4-5-14-11(9-12)3-2-7-15-14/h2-10,17H,1H3,(H,16,18)
InChIKeyASXNRJHBWWYTMU-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.13
Rot. Bonds3

About N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine

N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine (PubChem CID 55097402) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine.

Molecular Properties

Compound NameN-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine
PubChem CID55097402
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC NameN-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine
SMILESCC(Nc1ccc2ncccc2c1)c1ccn[nH]1
InChIInChI=1S/C14H14N4/c1-10(13-6-8-16-18-13)17-12-4-5-14-11(9-12)3-2-7-15-14/h2-10,17H,1H3,(H,16,18)
InChIKeyASXNRJHBWWYTMU-UHFFFAOYSA-N
XLogP3.13
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1,3-thiazol-4-yl)ethyl]quinolin-6-amine
CID 115928696
N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine
CID 62636644
N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine
CID 62634409
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]quinolin-6-amine
CID 63753119
N-[1-(2,5-difluorophenyl)ethyl]quinolin-6-amine
CID 62634757
3-iodo-4-methyl-N-[1-(1H-pyrazol-5-yl)ethyl]aniline
CID 60972545
N-(1-cyclopropylpropan-2-yl)quinolin-6-amine
CID 115928694
N-[1-(3-chloro-4-fluorophenyl)ethyl]quinolin-6-amine
CID 62636651
3-methyl-2-(quinolin-6-ylamino)butanoic acid
CID 82539325
N-hexan-2-ylquinolin-6-amine
CID 62636483
N-heptan-3-ylquinolin-6-amine
CID 63946746
methyl 2-(quinolin-6-ylamino)propanoate
CID 66172945

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine?
The IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine (CID 55097402) is N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine.
What is the SMILES notation for N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine?
The canonical SMILES for N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine is CC(Nc1ccc2ncccc2c1)c1ccn[nH]1.
What is the InChIKey of N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine?
The InChIKey is ASXNRJHBWWYTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-10(13-6-8-16-18-13)17-12-4-5-14-11(9-12)3-2-7-15-14/h2-10,17H,1H3,(H,16,18).
What are the key properties of N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine?
N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine has a molecular weight of 238.29 g/mol, XLogP of 3.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine is sourced from PubChem (CID 55097402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).