N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide

C19H24N4O2 — CID 75590828

IUPACN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide
SMILESCOc1nc(C)cc(C)c1CNC(=O)C1CNNC1c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-12-9-13(2)22-19(25-3)15(12)10-20-18(24)16-11-21-23-17(16)14-7-5-4-6-8-14/h4-9,16-17,21,23H,10-11H2,1-3H3,(H,20,24)
InChIKeyYSCQVSXXHARZDG-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.79
Rot. Bonds5

About N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide

N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide (PubChem CID 75590828) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide
PubChem CID75590828
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide
SMILESCOc1nc(C)cc(C)c1CNC(=O)C1CNNC1c1ccccc1
InChIInChI=1S/C19H24N4O2/c1-12-9-13(2)22-19(25-3)15(12)10-20-18(24)16-11-21-23-17(16)14-7-5-4-6-8-14/h4-9,16-17,21,23H,10-11H2,1-3H3,(H,20,24)
InChIKeyYSCQVSXXHARZDG-UHFFFAOYSA-N
XLogP1.79
TPSA75.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide?
The IUPAC name of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide (CID 75590828) is N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide.
What is the SMILES notation for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide?
The canonical SMILES for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide is COc1nc(C)cc(C)c1CNC(=O)C1CNNC1c1ccccc1.
What is the InChIKey of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide?
The InChIKey is YSCQVSXXHARZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-12-9-13(2)22-19(25-3)15(12)10-20-18(24)16-11-21-23-17(16)14-7-5-4-6-8-14/h4-9,16-17,21,23H,10-11H2,1-3H3,(H,20,24).
What are the key properties of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide?
N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 1.79, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-3-phenylpyrazolidine-4-carboxamide is sourced from PubChem (CID 75590828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).