N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide

C18H22N4O — CID 118450392

IUPACN,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-c2ccccn2)CC1
InChIInChI=1S/C18H22N4O/c1-21(2)18(23)14-7-11-22(12-8-14)17-13-19-10-6-15(17)16-5-3-4-9-20-16/h3-6,9-10,13-14H,7-8,11-12H2,1-2H3
InChIKeyREWJXLCPBULRSV-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.45
Rot. Bonds3

About N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide

N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide (PubChem CID 118450392) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide
PubChem CID118450392
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC NameN,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-c2ccccn2)CC1
InChIInChI=1S/C18H22N4O/c1-21(2)18(23)14-7-11-22(12-8-14)17-13-19-10-6-15(17)16-5-3-4-9-20-16/h3-6,9-10,13-14H,7-8,11-12H2,1-2H3
InChIKeyREWJXLCPBULRSV-UHFFFAOYSA-N
XLogP2.45
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-cyano-3-pyridinyl)-N,N-dimethylpyrrolidine-3-carboxamide
CID 172890931
1-[4-(4-cyanopyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide
CID 118450678
1-(6-bromoquinolin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 22031560
3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridin-2-ylpyridine
CID 59522846
1-(3-fluoropyridine-4-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 115646226
N-[2-(dimethylamino)ethyl]-4-(2-pyridin-2-ylphenyl)piperazine-1-carboxamide
CID 102056903
N,N-dimethyl-2-[(1-pyridin-2-ylpiperidin-4-yl)amino]propanamide
CID 43778088
(3,3-difluoroazetidin-1-yl)-[1-[4-(2-methyl-1,3-oxazol-4-yl)-3-pyridinyl]piperidin-4-yl]methanone
CID 118450651
1-(5-cyano-2-pyridinyl)-N,N-dimethylpiperidine-4-carboxamide
CID 51300981
1-(4-methoxypyrimidin-2-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 31968556
1-(3-bromo-5-chloro-2-pyridinyl)-N,N-dimethylpiperidine-4-carboxamide
CID 171690791
1-(1-pyridin-2-ylpiperidin-4-yl)ethanone
CID 63845661

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide (CID 118450392) is N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide is CN(C)C(=O)C1CCN(c2cnccc2-c2ccccn2)CC1.
What is the InChIKey of N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide?
The InChIKey is REWJXLCPBULRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c1-21(2)18(23)14-7-11-22(12-8-14)17-13-19-10-6-15(17)16-5-3-4-9-20-16/h3-6,9-10,13-14H,7-8,11-12H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide?
N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(4-pyridin-2-yl-3-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 118450392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).