N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide

C13H19N3O — CID 175589631

IUPACN,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide
SMILESC[C@@H]1CCCN1c1cc(C(=O)N(C)C)ccn1
InChIInChI=1S/C13H19N3O/c1-10-5-4-8-16(10)12-9-11(6-7-14-12)13(17)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3/t10-/m1/s1
InChIKeyWWVIBSAWXBILQL-SNVBAGLBSA-N
MW233.31 g/mol
LogP1.77
Rot. Bonds2

About N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide

N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide (PubChem CID 175589631) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide
PubChem CID175589631
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide
SMILESC[C@@H]1CCCN1c1cc(C(=O)N(C)C)ccn1
InChIInChI=1S/C13H19N3O/c1-10-5-4-8-16(10)12-9-11(6-7-14-12)13(17)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3/t10-/m1/s1
InChIKeyWWVIBSAWXBILQL-SNVBAGLBSA-N
XLogP1.77
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)-2-oxoethyl]-N-ethyl-2-[(2S)-2-methylpiperidin-1-yl]pyridine-4-carboxamide
CID 94811507
[2-(2-methylpiperidin-1-yl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 166191035
2-[(2R)-2-ethylpyrrolidin-1-yl]pyridine-4-carboxylic acid
CID 93394486
N-[2-(4-methylpiperazin-1-yl)ethyl]-2-[(2R)-2-methylpiperidin-1-yl]pyridine-4-carboxamide
CID 95281237
2-[(2R)-2-methylpiperidin-1-yl]-N-[2-(pyrimidin-2-ylamino)ethyl]pyridine-4-carboxamide
CID 95313062
2-chloro-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboxylic acid
CID 60973947
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine
CID 62286079
2-[2-(methylaminomethyl)pyrrolidin-1-yl]pyridine-4-carboxamide
CID 113285409
N-cyclohexyl-N-methyl-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 84574966
2-chloro-3-formyl-N,N-dimethyl-6-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide
CID 167495014
(2-methylpiperidin-1-yl)-(2-pyrrolidin-1-yl-4-pyridinyl)methanone
CID 84574688
5-bromo-2-[(2S)-2-methylpyrrolidin-1-yl]pyridine-4-carboxylic acid
CID 167919180

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The IUPAC name of N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide (CID 175589631) is N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide is C[C@@H]1CCCN1c1cc(C(=O)N(C)C)ccn1.
What is the InChIKey of N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The InChIKey is WWVIBSAWXBILQL-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10-5-4-8-16(10)12-9-11(6-7-14-12)13(17)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3/t10-/m1/s1.
What are the key properties of N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(2R)-2-methylpyrrolidin-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 175589631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).