N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide

C12H17N3O — CID 115590459

IUPACN-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
SMILESCN(Cc1ccccn1)C(=O)N1CCCC1
InChIInChI=1S/C12H17N3O/c1-14(10-11-6-2-3-7-13-11)12(16)15-8-4-5-9-15/h2-3,6-7H,4-5,8-10H2,1H3
InChIKeyHMOOIUNOJNVTBB-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.73
Rot. Bonds2

About N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide

N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide (PubChem CID 115590459) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
PubChem CID115590459
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC NameN-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
SMILESCN(Cc1ccccn1)C(=O)N1CCCC1
InChIInChI=1S/C12H17N3O/c1-14(10-11-6-2-3-7-13-11)12(16)15-8-4-5-9-15/h2-3,6-7H,4-5,8-10H2,1H3
InChIKeyHMOOIUNOJNVTBB-UHFFFAOYSA-N
XLogP1.73
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide
CID 115684547
2-(1,4-diazepan-1-yl)-N-methyl-2-oxo-N-(pyridin-2-ylmethyl)acetamide
CID 43565765
1-methyl-1-(pyridin-2-ylmethyl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]urea
CID 47490267
1-methyl-3-(2-methyl-3-pyrrolidin-1-ylpropyl)-1-(pyridin-2-ylmethyl)urea
CID 86841958
3-methyl-1-[methyl(pyridin-2-ylmethyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 102781852
N-methyl-N-pyridin-2-ylpyrrolidine-1-carboxamide
CID 116653994
N-methyl-N-(1,3-thiazol-4-ylmethyl)pyrrolidine-1-carboxamide
CID 115592952
1-(2,2-dimethylpropanoyl)-N-methyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 86824162
1-[4-[methyl(pyridin-2-ylmethyl)amino]piperidin-1-yl]ethanone
CID 83290596
N'-methyl-N'-(pyridin-2-ylmethyl)oxamide
CID 115192026
N-[(2-chlorophenyl)methyl]-N-methylpiperidine-1-carboxamide
CID 115578615
2-(2-pyridin-2-ylethylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 43083640

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide (CID 115590459) is N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide is CN(Cc1ccccn1)C(=O)N1CCCC1.
What is the InChIKey of N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide?
The InChIKey is HMOOIUNOJNVTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-14(10-11-6-2-3-7-13-11)12(16)15-8-4-5-9-15/h2-3,6-7H,4-5,8-10H2,1H3.
What are the key properties of N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide?
N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 115590459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).