N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide

C19H29N3O2 — CID 75462417

IUPACN-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide
SMILESCn1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1=O
InChIInChI=1S/C19H29N3O2/c1-21-10-7-15(13-18(21)23)14-22-11-8-17(9-12-22)20-19(24)16-5-3-2-4-6-16/h7,10,13,16-17H,2-6,8-9,11-12,14H2,1H3,(H,20,24)
InChIKeyFDFQLPXYVCQOBC-UHFFFAOYSA-N
MW331.46 g/mol
LogP2.05
Rot. Bonds4

About N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide

N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 75462417) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide
PubChem CID75462417
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC NameN-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide
SMILESCn1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1=O
InChIInChI=1S/C19H29N3O2/c1-21-10-7-15(13-18(21)23)14-22-11-8-17(9-12-22)20-19(24)16-5-3-2-4-6-16/h7,10,13,16-17H,2-6,8-9,11-12,14H2,1H3,(H,20,24)
InChIKeyFDFQLPXYVCQOBC-UHFFFAOYSA-N
XLogP2.05
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-[(1-methyl-2-oxo-4-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 47377026
N-(1-benzylpiperidin-4-yl)cyclobutanecarboxamide
CID 2729529
N-cyclopentyl-1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 3645638
1-benzyl-N-cyclopentylpiperidine-4-carboxamide
CID 2186968
N-cyclooctyl-1-methyl-2-oxopyridine-4-carboxamide
CID 103610769
N-[1-[(3-cyclopentyloxyphenyl)methyl]piperidin-4-yl]cyclopropanecarboxamide
CID 154793860
1-acetyl-N-(1-benzylpiperidin-4-yl)piperidine-4-carboxamide
CID 108804424
4-[[4-[2-(dimethylamino)ethyl]piperidin-1-yl]methyl]-1-methylpyridin-2-one
CID 75461791
4-[[4-(2,3-dihydroindole-1-carbonyl)piperidin-1-yl]methyl]-1-methylpyridin-2-one
CID 172891645
N-cyclohexyl-1-[(3-methylphenyl)methyl]piperidine-3-carboxamide
CID 43918586
N-cycloheptyl-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 30137317
1-methyl-4-[(4-phenoxypiperidin-1-yl)methyl]pyridin-2-one
CID 47545020

Frequently Asked Questions

What is the IUPAC name of N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide (CID 75462417) is N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide is Cn1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1=O.
What is the InChIKey of N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is FDFQLPXYVCQOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-21-10-7-15(13-18(21)23)14-22-11-8-17(9-12-22)20-19(24)16-5-3-2-4-6-16/h7,10,13,16-17H,2-6,8-9,11-12,14H2,1H3,(H,20,24).
What are the key properties of N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide?
N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 331.46 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(1-methyl-2-oxo-4-pyridinyl)methyl]piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 75462417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).