N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

C18H25N5O2 — CID 129009371

IUPACN-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCn1nccc1C1=CCN(C(=O)NC2CCC(=O)NC2C2CC2)CC1
InChIInChI=1S/C18H25N5O2/c1-22-15(6-9-19-22)12-7-10-23(11-8-12)18(25)20-14-4-5-16(24)21-17(14)13-2-3-13/h6-7,9,13-14,17H,2-5,8,10-11H2,1H3,(H,20,25)(H,21,24)
InChIKeyYLIORFBQSPYYLL-UHFFFAOYSA-N
MW343.43 g/mol
LogP1.28
Rot. Bonds3

About N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 129009371) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID129009371
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC NameN-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCn1nccc1C1=CCN(C(=O)NC2CCC(=O)NC2C2CC2)CC1
InChIInChI=1S/C18H25N5O2/c1-22-15(6-9-19-22)12-7-10-23(11-8-12)18(25)20-14-4-5-16(24)21-17(14)13-2-3-13/h6-7,9,13-14,17H,2-5,8,10-11H2,1H3,(H,20,25)(H,21,24)
InChIKeyYLIORFBQSPYYLL-UHFFFAOYSA-N
XLogP1.28
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide (CID 129009371) is N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide is Cn1nccc1C1=CCN(C(=O)NC2CCC(=O)NC2C2CC2)CC1.
What is the InChIKey of N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is YLIORFBQSPYYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-22-15(6-9-19-22)12-7-10-23(11-8-12)18(25)20-14-4-5-16(24)21-17(14)13-2-3-13/h6-7,9,13-14,17H,2-5,8,10-11H2,1H3,(H,20,25)(H,21,24).
What are the key properties of N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide?
N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-6-oxopiperidin-3-yl)-4-(2-methylpyrazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 129009371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).