4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide

C12H17N3O2 — CID 63327667

IUPAC4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)Nc2cnccc2C)C1
InChIInChI=1S/C12H17N3O2/c1-8-3-4-13-7-11(8)15-12(16)10-5-9(17-2)6-14-10/h3-4,7,9-10,14H,5-6H2,1-2H3,(H,15,16)
InChIKeySGQUAWRWBGDGHP-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.71
Rot. Bonds3

About 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide

4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide (PubChem CID 63327667) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
PubChem CID63327667
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)Nc2cnccc2C)C1
InChIInChI=1S/C12H17N3O2/c1-8-3-4-13-7-11(8)15-12(16)10-5-9(17-2)6-14-10/h3-4,7,9-10,14H,5-6H2,1-2H3,(H,15,16)
InChIKeySGQUAWRWBGDGHP-UHFFFAOYSA-N
XLogP0.71
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(2-methylphenyl)pyrrolidine-2-carboxamide
CID 61214161
methyl 3-[(4-methoxypyrrolidine-2-carbonyl)amino]-4-methylbenzoate
CID 61213741
N-(6-bromo-2-methyl-3-pyridinyl)-4-methoxypyrrolidine-2-carboxamide
CID 114050908
(2S)-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 63327750
N-(2-chloro-5-methylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 103832911
2-[(4-methoxypyrrolidine-2-carbonyl)amino]benzoic acid
CID 61213078
4-methoxy-N-(2-methylsulfanylphenyl)pyrrolidine-2-carboxamide
CID 61214477
4-methoxy-N-phenylpyrrolidine-2-carboxamide
CID 61213145
N-(2-imidazol-1-ylphenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214618
4-methoxy-N-[2-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide
CID 61215179
N-(2,4-dibromophenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214476
N-(2,5-difluorophenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214007

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide (CID 63327667) is 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide is COC1CNC(C(=O)Nc2cnccc2C)C1.
What is the InChIKey of 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide?
The InChIKey is SGQUAWRWBGDGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-8-3-4-13-7-11(8)15-12(16)10-5-9(17-2)6-14-10/h3-4,7,9-10,14H,5-6H2,1-2H3,(H,15,16).
What are the key properties of 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide?
4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 63327667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).