N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide

C16H24N4O2 — CID 110822407

IUPACN-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)N1CCC(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C16H24N4O2/c1-16(2,3)19-15(22)20-10-7-12(8-11-20)18-14(21)13-6-4-5-9-17-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,18,21)(H,19,22)
InChIKeyKKUULOBXVICKDK-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.78
Rot. Bonds2

About N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide

N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide (PubChem CID 110822407) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide
PubChem CID110822407
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)N1CCC(NC(=O)c2ccccn2)CC1
InChIInChI=1S/C16H24N4O2/c1-16(2,3)19-15(22)20-10-7-12(8-11-20)18-14(21)13-6-4-5-9-17-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,18,21)(H,19,22)
InChIKeyKKUULOBXVICKDK-UHFFFAOYSA-N
XLogP1.78
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-chloro-2,2-dimethylpropanoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108562781
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
N-[1-(1-tert-butyl-5-oxopyrrolidine-3-carbonyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557834
N-(1-ethylpiperidin-4-yl)pyridine-2-carboxamide
CID 69401322
N-tert-butyl-4-(pyridine-2-carbonyl)-1,4-diazepane-1-carboxamide
CID 110813237
N-[(3R)-1-methylpyrrolidin-3-yl]pyridine-2-carboxamide
CID 59568965
N-[1-(tert-butylcarbamoyl)piperidin-4-yl]-5-(dimethylamino)pyrazine-2-carboxamide
CID 154739087
N-(1-ethylsulfonylpiperidin-4-yl)pyridine-2-carboxamide
CID 47021102
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557881
N-[1-(2-bromobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557809
N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 24633709
N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110820295

Frequently Asked Questions

What is the IUPAC name of N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide (CID 110822407) is N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide is CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccccn2)CC1.
What is the InChIKey of N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide?
The InChIKey is KKUULOBXVICKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-16(2,3)19-15(22)20-10-7-12(8-11-20)18-14(21)13-6-4-5-9-17-13/h4-6,9,12H,7-8,10-11H2,1-3H3,(H,18,21)(H,19,22).
What are the key properties of N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide?
N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(tert-butylcarbamoyl)piperidin-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 110822407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).