2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide

C14H24N4O — CID 106050180

IUPAC2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)NCCCN(C)C(C)C
InChIInChI=1S/C14H24N4O/c1-11(2)18(4)10-6-9-17-14(19)12-7-5-8-16-13(12)15-3/h5,7-8,11H,6,9-10H2,1-4H3,(H,15,16)(H,17,19)
InChIKeyZHPFSADTJQPJFU-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.58
Rot. Bonds7

About 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide

2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide (PubChem CID 106050180) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide
PubChem CID106050180
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)NCCCN(C)C(C)C
InChIInChI=1S/C14H24N4O/c1-11(2)18(4)10-6-9-17-14(19)12-7-5-8-16-13(12)15-3/h5,7-8,11H,6,9-10H2,1-4H3,(H,15,16)(H,17,19)
InChIKeyZHPFSADTJQPJFU-UHFFFAOYSA-N
XLogP1.58
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[4-[methyl(propan-2-yl)amino]butyl]pyridine-3-carboxamide
CID 62159579
N-[3-(dimethylamino)propyl]-2-hydrazinylpyridine-3-carboxamide
CID 60920879
5-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-2-carboxamide
CID 106050159
N-methyl-2-(methylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 62166706
2-(methylamino)-N-(3-phenylbutyl)pyridine-3-carboxamide
CID 62986832
6-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridazine-3-carboxamide
CID 106050253
2-amino-3-methyl-N-[3-[methyl(propan-2-yl)amino]propyl]benzamide
CID 106033190
6-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-2-carboxamide
CID 106050169
N-[(2S)-3-(dimethylamino)-2-hydroxypropyl]-2-(methylamino)pyridine-3-carboxamide
CID 125436111
2-hydrazinyl-N-(5-methylhexyl)pyridine-3-carboxamide
CID 115327334
2-(methylamino)-N-(3-methylbutan-2-yl)pyridine-3-carboxamide
CID 62167336
3-amino-2-chloro-N-[3-[methyl(propan-2-yl)amino]propyl]benzamide
CID 106033172

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide?
The IUPAC name of 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide (CID 106050180) is 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide is CNc1ncccc1C(=O)NCCCN(C)C(C)C.
What is the InChIKey of 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide?
The InChIKey is ZHPFSADTJQPJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11(2)18(4)10-6-9-17-14(19)12-7-5-8-16-13(12)15-3/h5,7-8,11H,6,9-10H2,1-4H3,(H,15,16)(H,17,19).
What are the key properties of 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide?
2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-3-carboxamide is sourced from PubChem (CID 106050180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).