N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide

C13H19N3O — CID 115684547

IUPACN-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide
SMILESCc1cccc(CN(C)C(=O)N2CCCC2)n1
InChIInChI=1S/C13H19N3O/c1-11-6-5-7-12(14-11)10-15(2)13(17)16-8-3-4-9-16/h5-7H,3-4,8-10H2,1-2H3
InChIKeyHNFLNKFWHZBMQH-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.04
Rot. Bonds2

About N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide

N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide (PubChem CID 115684547) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide
PubChem CID115684547
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide
SMILESCc1cccc(CN(C)C(=O)N2CCCC2)n1
InChIInChI=1S/C13H19N3O/c1-11-6-5-7-12(14-11)10-15(2)13(17)16-8-3-4-9-16/h5-7H,3-4,8-10H2,1-2H3
InChIKeyHNFLNKFWHZBMQH-UHFFFAOYSA-N
XLogP2.04
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(pyridin-2-ylmethyl)pyrrolidine-1-carboxamide
CID 115590459
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 23402951
ethane;N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 143432699
3-methyl-1-[methyl-[(6-methyl-2-pyridinyl)methyl]carbamoyl]pyrrolidine-2-carboxylic acid
CID 102782902
3,4-dihydroxy-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 103957226
2-ethoxy-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 79018444
N-methyl-N-(1,3-thiazol-4-ylmethyl)pyrrolidine-1-carboxamide
CID 115592952
2,2-dimethyl-3-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-oxopropanoic acid
CID 82820939
3-[(6-methyl-2-pyridinyl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 113411343
N-[(2-chlorophenyl)methyl]-N-methylpiperidine-1-carboxamide
CID 115578615
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 142111486
4-[[methyl(pyrrolidine-1-carbonyl)amino]methyl]benzoic acid
CID 61187481

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide (CID 115684547) is N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide is Cc1cccc(CN(C)C(=O)N2CCCC2)n1.
What is the InChIKey of N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide?
The InChIKey is HNFLNKFWHZBMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-11-6-5-7-12(14-11)10-15(2)13(17)16-8-3-4-9-16/h5-7H,3-4,8-10H2,1-2H3.
What are the key properties of N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide?
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 115684547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).