N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide

C18H20N4O2 — CID 2997445

IUPACN-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccnc1N1CCCCC1
InChIInChI=1S/C18H20N4O2/c19-16(23)13-7-2-3-9-15(13)21-18(24)14-8-6-10-20-17(14)22-11-4-1-5-12-22/h2-3,6-10H,1,4-5,11-12H2,(H2,19,23)(H,21,24)
InChIKeyLUUYUIANPCXSFW-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.42
Rot. Bonds4

About N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide

N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 2997445) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide
PubChem CID2997445
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)c1cccnc1N1CCCCC1
InChIInChI=1S/C18H20N4O2/c19-16(23)13-7-2-3-9-15(13)21-18(24)14-8-6-10-20-17(14)22-11-4-1-5-12-22/h2-3,6-10H,1,4-5,11-12H2,(H2,19,23)(H,21,24)
InChIKeyLUUYUIANPCXSFW-UHFFFAOYSA-N
XLogP2.42
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide (CID 2997445) is N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide is NC(=O)c1ccccc1NC(=O)c1cccnc1N1CCCCC1.
What is the InChIKey of N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is LUUYUIANPCXSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c19-16(23)13-7-2-3-9-15(13)21-18(24)14-8-6-10-20-17(14)22-11-4-1-5-12-22/h2-3,6-10H,1,4-5,11-12H2,(H2,19,23)(H,21,24).
What are the key properties of N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide?
N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-2-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 2997445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).