N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide

C15H23N3O — CID 98719912

IUPACN-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide
SMILESC[C@H](CNC(=O)c1ccncc1)N1CCCC[C@@H]1C
InChIInChI=1S/C15H23N3O/c1-12-5-3-4-10-18(12)13(2)11-17-15(19)14-6-8-16-9-7-14/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,17,19)/t12-,13+/m0/s1
InChIKeyFKLPQCDXROZPPR-QWHCGFSZSA-N
MW261.37 g/mol
LogP2.07
Rot. Bonds4

About N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide

N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide (PubChem CID 98719912) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide
PubChem CID98719912
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide
SMILESC[C@H](CNC(=O)c1ccncc1)N1CCCC[C@@H]1C
InChIInChI=1S/C15H23N3O/c1-12-5-3-4-10-18(12)13(2)11-17-15(19)14-6-8-16-9-7-14/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,17,19)/t12-,13+/m0/s1
InChIKeyFKLPQCDXROZPPR-QWHCGFSZSA-N
XLogP2.07
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]-2-morpholin-4-ylpyridine-3-carboxamide
CID 124732893
(E)-N-[2-(2-methylpiperidin-1-yl)propyl]-3-pyridin-3-ylprop-2-enamide
CID 51090122
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide
CID 42958335
1-(2-chlorophenyl)-3-[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]urea
CID 129368276
4-ethyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-yl]propyl]thiadiazole-5-carboxamide
CID 92863122
1-(3,4-dichlorophenyl)-3-[2-(2-methylpiperidin-1-yl)propyl]thiourea
CID 43076905
1-[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]-3-(2,4,6-trimethylphenyl)urea
CID 129418976
1-(2,5-dimethylpyrazol-3-yl)-3-[2-(2-methylpiperidin-1-yl)propyl]urea
CID 51080593
N-[4-[[3-methyl-2-(4-methylpiperidin-1-yl)butyl]carbamoyl]phenyl]pyridine-4-carboxamide
CID 56808571
1-[(2S)-2-[(2S)-2-methylpiperidin-1-yl]propyl]-3-[(2-methyl-1,3-thiazol-4-yl)methyl]urea
CID 94047885
methyl 4-[[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]sulfamoyl]benzoate
CID 39664343
4-[[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]sulfamoyl]benzamide
CID 124839638

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide?
The IUPAC name of N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide (CID 98719912) is N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide?
The canonical SMILES for N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide is C[C@H](CNC(=O)c1ccncc1)N1CCCC[C@@H]1C.
What is the InChIKey of N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide?
The InChIKey is FKLPQCDXROZPPR-QWHCGFSZSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12-5-3-4-10-18(12)13(2)11-17-15(19)14-6-8-16-9-7-14/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,17,19)/t12-,13+/m0/s1.
What are the key properties of N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide?
N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-[(2S)-2-methylpiperidin-1-yl]propyl]pyridine-4-carboxamide is sourced from PubChem (CID 98719912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).