1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide

C15H23N3O2 — CID 74231255

IUPAC1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide
SMILESCc1cc(C(=O)NCC[C@@H]2CCCN2)c(=O)n(C)c1C
InChIInChI=1S/C15H23N3O2/c1-10-9-13(15(20)18(3)11(10)2)14(19)17-8-6-12-5-4-7-16-12/h9,12,16H,4-8H2,1-3H3,(H,17,19)/t12-/m0/s1
InChIKeyHYBAUEDVZLZLHF-LBPRGKRZSA-N
MW277.37 g/mol
LogP0.87
Rot. Bonds4

About 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide

1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide (PubChem CID 74231255) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide
PubChem CID74231255
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide
SMILESCc1cc(C(=O)NCC[C@@H]2CCCN2)c(=O)n(C)c1C
InChIInChI=1S/C15H23N3O2/c1-10-9-13(15(20)18(3)11(10)2)14(19)17-8-6-12-5-4-7-16-12/h9,12,16H,4-8H2,1-3H3,(H,17,19)/t12-/m0/s1
InChIKeyHYBAUEDVZLZLHF-LBPRGKRZSA-N
XLogP0.87
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793749
5-fluoro-2-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793819
6-methyl-4-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1H-pyridine-3-carboxamide
CID 104955353
2-hydroxy-5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104972264
2-bromo-4-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104971649
1-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrrole-2-carboxamide
CID 104955194
3-bromo-4-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793684
3-ethyl-6-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridazine-4-carboxamide
CID 104971654
5-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrazine-2-carboxamide
CID 104955274
2-ethyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793888
2,4-dihydroxy-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793797
5-bromo-4-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]thiophene-2-carboxamide
CID 104955216

Frequently Asked Questions

What is the IUPAC name of 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide?
The IUPAC name of 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide (CID 74231255) is 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide?
The canonical SMILES for 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide is Cc1cc(C(=O)NCC[C@@H]2CCCN2)c(=O)n(C)c1C.
What is the InChIKey of 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide?
The InChIKey is HYBAUEDVZLZLHF-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-9-13(15(20)18(3)11(10)2)14(19)17-8-6-12-5-4-7-16-12/h9,12,16H,4-8H2,1-3H3,(H,17,19)/t12-/m0/s1.
What are the key properties of 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide?
1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,6-trimethyl-2-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 74231255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).