2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide

C25H29N5O2 — CID 38435626

IUPAC2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide
SMILESCN(C)Cc1ccccc1NC(=O)c1cccc(C(=O)Nc2ccccc2CN(C)C)n1
InChIInChI=1S/C25H29N5O2/c1-29(2)16-18-10-5-7-12-20(18)27-24(31)22-14-9-15-23(26-22)25(32)28-21-13-8-6-11-19(21)17-30(3)4/h5-15H,16-17H2,1-4H3,(H,27,31)(H,28,32)
InChIKeyAVNKGYFYYZJJBM-UHFFFAOYSA-N
MW431.54 g/mol
LogP3.71
Rot. Bonds8

About 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide

2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide (PubChem CID 38435626) has the molecular formula C25H29N5O2 and a molecular weight of 431.54 g/mol. Its IUPAC name is 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide
PubChem CID38435626
Molecular FormulaC25H29N5O2
Molecular Weight431.54 g/mol
Exact Mass431.23
IUPAC Name2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide
SMILESCN(C)Cc1ccccc1NC(=O)c1cccc(C(=O)Nc2ccccc2CN(C)C)n1
InChIInChI=1S/C25H29N5O2/c1-29(2)16-18-10-5-7-12-20(18)27-24(31)22-14-9-15-23(26-22)25(32)28-21-13-8-6-11-19(21)17-30(3)4/h5-15H,16-17H2,1-4H3,(H,27,31)(H,28,32)
InChIKeyAVNKGYFYYZJJBM-UHFFFAOYSA-N
XLogP3.71
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.54
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[[acetyl(methyl)amino]methyl]phenyl]-6-methylpyridine-2-carboxamide
CID 39277115
N-[2-[(dimethylamino)methyl]phenyl]acetamide;ethane
CID 142252989
N-[2-[(dimethylamino)methyl]phenyl]-3-hydroxybenzamide
CID 110472375
N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
CID 38436270
2-amino-N-[2-[(dimethylamino)methyl]phenyl]acetamide
CID 43695681
6-(ethylamino)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 62240641
4-chloro-N-[2-[(dimethylamino)methyl]phenyl]-6-methylpyridine-3-carboxamide
CID 81227997
4-amino-N-[2-[(dimethylamino)methyl]phenyl]-1,2,5-oxadiazole-3-carboxamide
CID 55103614
6-bromo-N-[2-[(dimethylamino)methyl]phenyl]pyridine-3-carboxamide
CID 66464873
6-N-(2-ethylphenyl)-2-N-(3-fluorophenyl)pyridine-2,6-dicarboxamide
CID 109100559
6-N-(2-chlorophenyl)-2-N-[3-(dimethylamino)propyl]pyridine-2,6-dicarboxamide
CID 109096585
N-(2-ethylphenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095186

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide (CID 38435626) is 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide is CN(C)Cc1ccccc1NC(=O)c1cccc(C(=O)Nc2ccccc2CN(C)C)n1.
What is the InChIKey of 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide?
The InChIKey is AVNKGYFYYZJJBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O2/c1-29(2)16-18-10-5-7-12-20(18)27-24(31)22-14-9-15-23(26-22)25(32)28-21-13-8-6-11-19(21)17-30(3)4/h5-15H,16-17H2,1-4H3,(H,27,31)(H,28,32).
What are the key properties of 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide?
2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide has a molecular weight of 431.54 g/mol, XLogP of 3.71, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis[2-[(dimethylamino)methyl]phenyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 38435626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).