methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate

C15H19N5O2 — CID 67388698

IUPACmethyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate
SMILESCOC(=O)c1cc(-c2cnn(C3CCNCC3)c2)cnc1N
InChIInChI=1S/C15H19N5O2/c1-22-15(21)13-6-10(7-18-14(13)16)11-8-19-20(9-11)12-2-4-17-5-3-12/h6-9,12,17H,2-5H2,1H3,(H2,16,18)
InChIKeyQUWXHDAOMQAJTH-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.24
Rot. Bonds3

About methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate

methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate (PubChem CID 67388698) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate
PubChem CID67388698
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Namemethyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate
SMILESCOC(=O)c1cc(-c2cnn(C3CCNCC3)c2)cnc1N
InChIInChI=1S/C15H19N5O2/c1-22-15(21)13-6-10(7-18-14(13)16)11-8-19-20(9-11)12-2-4-17-5-3-12/h6-9,12,17H,2-5H2,1H3,(H2,16,18)
InChIKeyQUWXHDAOMQAJTH-UHFFFAOYSA-N
XLogP1.24
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]pyridine-3-carboxylic acid
CID 67388257
2-amino-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]pyridine-3-carboxylic acid;hydrochloride
CID 67388256
2-amino-N-[1-(2-hydroxy-1-phenylethyl)pyrrolidin-3-yl]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxamide
CID 162511173
tert-butyl 4-[4-[6-amino-5-[(4-aminophenyl)carbamoyl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate
CID 164524533
3-[(2-methoxyphenyl)methoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine
CID 162656396
methyl 5-amino-2-(1-cyclopropylpyrazol-4-yl)benzoate
CID 162426999
tert-butyl 4-[4-[6-amino-5-[(2-methoxyphenyl)carbamoyl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate
CID 164524549
3-amino-6-(1-piperidin-4-ylpyrazol-4-yl)pyrazine-2-carboxylic acid
CID 163221724
3-[2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]-N-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 142746604
tert-butyl 4-[4-[6-amino-5-[(2-fluorophenyl)carbamoyl]-3-pyridinyl]pyrazol-1-yl]piperidine-1-carboxylate
CID 164524564
3-(4-amino-2-fluorophenyl)-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine;tert-butyl formate
CID 146424723
3-[2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)-3-pyridinyl]isoquinolin-6-ol
CID 136600714

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate?
The IUPAC name of methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate (CID 67388698) is methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate is COC(=O)c1cc(-c2cnn(C3CCNCC3)c2)cnc1N.
What is the InChIKey of methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate?
The InChIKey is QUWXHDAOMQAJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-22-15(21)13-6-10(7-18-14(13)16)11-8-19-20(9-11)12-2-4-17-5-3-12/h6-9,12,17H,2-5H2,1H3,(H2,16,18).
What are the key properties of methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate?
methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate has a molecular weight of 301.35 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-5-(1-piperidin-4-ylpyrazol-4-yl)pyridine-3-carboxylate is sourced from PubChem (CID 67388698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).