2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide

C24H30N4O3 — CID 86890412

IUPAC2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide
SMILESCc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)c1ccc(C(=O)N(C)C)nc1C
InChIInChI=1S/C24H30N4O3/c1-15-14-18(23(30)28-13-7-6-8-16(28)2)9-11-20(15)26-22(29)19-10-12-21(25-17(19)3)24(31)27(4)5/h9-12,14,16H,6-8,13H2,1-5H3,(H,26,29)
InChIKeyPVQBBFPEQLZJGW-UHFFFAOYSA-N
MW422.53 g/mol
LogP3.67
Rot. Bonds4

About 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide

2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide (PubChem CID 86890412) has the molecular formula C24H30N4O3 and a molecular weight of 422.53 g/mol. Its IUPAC name is 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide
PubChem CID86890412
Molecular FormulaC24H30N4O3
Molecular Weight422.53 g/mol
Exact Mass422.23
IUPAC Name2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide
SMILESCc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)c1ccc(C(=O)N(C)C)nc1C
InChIInChI=1S/C24H30N4O3/c1-15-14-18(23(30)28-13-7-6-8-16(28)2)9-11-20(15)26-22(29)19-10-12-21(25-17(19)3)24(31)27(4)5/h9-12,14,16H,6-8,13H2,1-5H3,(H,26,29)
InChIKeyPVQBBFPEQLZJGW-UHFFFAOYSA-N
XLogP3.67
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide (CID 86890412) is 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide is Cc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)c1ccc(C(=O)N(C)C)nc1C.
What is the InChIKey of 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide?
The InChIKey is PVQBBFPEQLZJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3/c1-15-14-18(23(30)28-13-7-6-8-16(28)2)9-11-20(15)26-22(29)19-10-12-21(25-17(19)3)24(31)27(4)5/h9-12,14,16H,6-8,13H2,1-5H3,(H,26,29).
What are the key properties of 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide?
2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide has a molecular weight of 422.53 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide is sourced from PubChem (CID 86890412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).