N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide

C13H22N4O — CID 63725681

IUPACN-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)N(C)CCCN(C)C)n1
InChIInChI=1S/C13H22N4O/c1-14-12-8-5-7-11(15-12)13(18)17(4)10-6-9-16(2)3/h5,7-8H,6,9-10H2,1-4H3,(H,14,15)
InChIKeyGXDGKTBOVODPJJ-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.15
Rot. Bonds6

About N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide

N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide (PubChem CID 63725681) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
PubChem CID63725681
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)N(C)CCCN(C)C)n1
InChIInChI=1S/C13H22N4O/c1-14-12-8-5-7-11(15-12)13(18)17(4)10-6-9-16(2)3/h5,7-8H,6,9-10H2,1-4H3,(H,14,15)
InChIKeyGXDGKTBOVODPJJ-UHFFFAOYSA-N
XLogP1.15
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)propyl]-6-(ethylamino)-N-methylpyridine-2-carboxamide
CID 63727068
N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-2-carboxamide
CID 63727240
N-(cyclopropylmethyl)-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 62238964
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 114953078
N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 62239255
6-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-2-carboxamide
CID 106050169
N-(2-hydroxy-3-methoxypropyl)-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 62233791
N-methyl-6-(methylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 62239472
N-methyl-6-(methylamino)-N-(oxan-4-ylmethyl)pyridine-2-carboxamide
CID 63707262
N-[2-(dimethylamino)ethyl]-N,6-dimethylpyridine-2-carboxamide
CID 110483041
6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
CID 80778351
N,N-bis(2-ethoxyethyl)-6-(methylamino)pyridine-2-carboxamide
CID 82941671

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide (CID 63725681) is N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide is CNc1cccc(C(=O)N(C)CCCN(C)C)n1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is GXDGKTBOVODPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-14-12-8-5-7-11(15-12)13(18)17(4)10-6-9-16(2)3/h5,7-8H,6,9-10H2,1-4H3,(H,14,15).
What are the key properties of N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide?
N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 63725681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).