N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C15H18N4O2 — CID 136533338

IUPACN-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cnn(C(C)C3CC3)c2)c(=O)[nH]1
InChIInChI=1S/C15H18N4O2/c1-9-3-6-13(14(20)17-9)15(21)18-12-7-16-19(8-12)10(2)11-4-5-11/h3,6-8,10-11H,4-5H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyNCCPIFXCMDEOSQ-UHFFFAOYSA-N
MW286.34 g/mol
LogP2.10
Rot. Bonds4

About N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 136533338) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID136533338
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC NameN-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cnn(C(C)C3CC3)c2)c(=O)[nH]1
InChIInChI=1S/C15H18N4O2/c1-9-3-6-13(14(20)17-9)15(21)18-12-7-16-19(8-12)10(2)11-4-5-11/h3,6-8,10-11H,4-5H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyNCCPIFXCMDEOSQ-UHFFFAOYSA-N
XLogP2.10
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 136533338) is N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)Nc2cnn(C(C)C3CC3)c2)c(=O)[nH]1.
What is the InChIKey of N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is NCCPIFXCMDEOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-9-3-6-13(14(20)17-9)15(21)18-12-7-16-19(8-12)10(2)11-4-5-11/h3,6-8,10-11H,4-5H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 136533338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).