8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine

C19H23N5 — CID 133394499

IUPAC8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine
SMILESCc1cccc2c(NC3CCCN(c4cnn(C)c4)C3)ccnc12
InChIInChI=1S/C19H23N5/c1-14-5-3-7-17-18(8-9-20-19(14)17)22-15-6-4-10-24(12-15)16-11-21-23(2)13-16/h3,5,7-9,11,13,15H,4,6,10,12H2,1-2H3,(H,20,22)
InChIKeyQADBXBHNXBSJHK-UHFFFAOYSA-N
MW321.43 g/mol
LogP3.36
Rot. Bonds3

About 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine

8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine (PubChem CID 133394499) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine.

Molecular Properties

Compound Name8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine
PubChem CID133394499
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine
SMILESCc1cccc2c(NC3CCCN(c4cnn(C)c4)C3)ccnc12
InChIInChI=1S/C19H23N5/c1-14-5-3-7-17-18(8-9-20-19(14)17)22-15-6-4-10-24(12-15)16-11-21-23(2)13-16/h3,5,7-9,11,13,15H,4,6,10,12H2,1-2H3,(H,20,22)
InChIKeyQADBXBHNXBSJHK-UHFFFAOYSA-N
XLogP3.36
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(1-methylpiperidin-3-yl)quinoline-4,8-diamine
CID 83060658
8-methyl-N-(thian-3-yl)quinolin-4-amine
CID 133368635
8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine
CID 65070427
N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]benzo[f]quinoline-5-carboxamide
CID 119032835
N-[(3R)-1-(1-methylpyrazol-4-yl)piperidin-3-yl]-4-(trifluoromethyl)pyridin-2-amine
CID 97221881
N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 136569033
5-bromo-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]pyridin-3-amine
CID 75494330
4-N-(1-methylpyrrolidin-3-yl)quinoline-4,8-diamine
CID 83061261
3-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 71870989
N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]-1,3-benzothiazol-2-amine
CID 133330150
N-methyl-2-[[1-(1-methylpyrazol-4-yl)piperidin-3-yl]amino]pyridine-3-carboxamide
CID 133330173
N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 133330027

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine?
The IUPAC name of 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine (CID 133394499) is 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine.
What is the SMILES notation for 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine?
The canonical SMILES for 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine is Cc1cccc2c(NC3CCCN(c4cnn(C)c4)C3)ccnc12.
What is the InChIKey of 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine?
The InChIKey is QADBXBHNXBSJHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5/c1-14-5-3-7-17-18(8-9-20-19(14)17)22-15-6-4-10-24(12-15)16-11-21-23(2)13-16/h3,5,7-9,11,13,15H,4,6,10,12H2,1-2H3,(H,20,22).
What are the key properties of 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine?
8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine has a molecular weight of 321.43 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]quinolin-4-amine is sourced from PubChem (CID 133394499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).