2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide

C19H22N4O2 — CID 146130820

IUPAC2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)ccn1
InChIInChI=1S/C19H22N4O2/c1-23(2)16-12-14(10-11-20-16)19(25)21-15-8-9-17(24)22-18(15)13-6-4-3-5-7-13/h3-7,10-12,15,18H,8-9H2,1-2H3,(H,21,25)(H,22,24)/t15-,18+/m1/s1
InChIKeyOHSXJMJNYAMXED-QAPCUYQASA-N
MW338.41 g/mol
LogP1.90
Rot. Bonds4

About 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide

2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide (PubChem CID 146130820) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide
PubChem CID146130820
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)ccn1
InChIInChI=1S/C19H22N4O2/c1-23(2)16-12-14(10-11-20-16)19(25)21-15-8-9-17(24)22-18(15)13-6-4-3-5-7-13/h3-7,10-12,15,18H,8-9H2,1-2H3,(H,21,25)(H,22,24)/t15-,18+/m1/s1
InChIKeyOHSXJMJNYAMXED-QAPCUYQASA-N
XLogP1.90
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-2-carboxamide
CID 146147900
N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 146130817
2-(dimethylamino)-N-(2-hydroxycyclohexyl)pyridine-4-carboxamide
CID 62361251
1,2,5-trimethyl-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyrrole-3-carboxamide
CID 146130842
5-ethyl-1-methyl-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyrazole-3-carboxamide
CID 146130844
3-[[(2R,3R)-2-(2-methylpyrazol-3-yl)-6-oxopiperidin-3-yl]carbamoyl]benzoic acid
CID 138001754
4-chloro-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]-1H-pyrrole-2-carboxamide
CID 146130814
4-chloro-2-fluoro-N-[(2R,3R)-6-oxo-2-phenylpiperidin-3-yl]benzamide
CID 95771187
2-(2,2-difluoroethyl)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyrazole-3-carboxamide
CID 146130848
[2-(dimethylamino)-4-pyridinyl]-[(3R)-3-phenylpiperidin-1-yl]methanone
CID 129352513
(5S,6R)-5-hydroxy-6-phenylpiperidin-2-one
CID 102384339
N-[2-(1-adamantylamino)phenyl]-2-(dimethylamino)pyridine-4-carboxamide
CID 60610002

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide (CID 146130820) is 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide is CN(C)c1cc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)ccn1.
What is the InChIKey of 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide?
The InChIKey is OHSXJMJNYAMXED-QAPCUYQASA-N. The full InChI is InChI=1S/C19H22N4O2/c1-23(2)16-12-14(10-11-20-16)19(25)21-15-8-9-17(24)22-18(15)13-6-4-3-5-7-13/h3-7,10-12,15,18H,8-9H2,1-2H3,(H,21,25)(H,22,24)/t15-,18+/m1/s1.
What are the key properties of 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide?
2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 146130820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).