N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide

C16H20N4O — CID 53014457

IUPACN-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide
SMILESCc1ccn(-c2ccc(C(=O)NC3CCCCC3)cn2)n1
InChIInChI=1S/C16H20N4O/c1-12-9-10-20(19-12)15-8-7-13(11-17-15)16(21)18-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,18,21)
InChIKeyLIZJXVRRERNNED-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.64
Rot. Bonds3

About N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide

N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide (PubChem CID 53014457) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide
PubChem CID53014457
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide
SMILESCc1ccn(-c2ccc(C(=O)NC3CCCCC3)cn2)n1
InChIInChI=1S/C16H20N4O/c1-12-9-10-20(19-12)15-8-7-13(11-17-15)16(21)18-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,18,21)
InChIKeyLIZJXVRRERNNED-UHFFFAOYSA-N
XLogP2.64
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide (CID 53014457) is N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide is Cc1ccn(-c2ccc(C(=O)NC3CCCCC3)cn2)n1.
What is the InChIKey of N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide?
The InChIKey is LIZJXVRRERNNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-12-9-10-20(19-12)15-8-7-13(11-17-15)16(21)18-14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,18,21).
What are the key properties of N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide?
N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(3-methylpyrazol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 53014457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).