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

C12H20N4O — CID 120828209

IUPAC6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
SMILESCNC(C)CNC(=O)c1ccc(N(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-9(13-2)7-15-12(17)10-5-6-11(14-8-10)16(3)4/h5-6,8-9,13H,7H2,1-4H3,(H,15,17)
InChIKeyQGZJVBXNFSLXSM-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.49
Rot. Bonds5

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

6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide (PubChem CID 120828209) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
PubChem CID120828209
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
SMILESCNC(C)CNC(=O)c1ccc(N(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-9(13-2)7-15-12(17)10-5-6-11(14-8-10)16(3)4/h5-6,8-9,13H,7H2,1-4H3,(H,15,17)
InChIKeyQGZJVBXNFSLXSM-UHFFFAOYSA-N
XLogP0.49
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120831653
N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119996612
6-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)pyridine-3-carboxamide
CID 103771018
2-[[[6-(dimethylamino)pyridine-3-carbonyl]amino]methyl]butanoic acid
CID 65219660
6-(dimethylamino)-N-[(2R)-1-hydroxypropan-2-yl]pyridine-3-carboxamide
CID 79031520
N-(3-aminobutyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119497031
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-6-(dimethylamino)pyridine-3-carboxamide
CID 110888066
N-[(2R)-2-(ethylamino)propyl]-6-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 120652365
6-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 80707921
6-(dimethylamino)-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-carboxamide
CID 111445550
6-(dimethylamino)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 95591154
6-(3,5-dimethylpyrazol-1-yl)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120827441

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The IUPAC name of 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide (CID 120828209) is 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide is CNC(C)CNC(=O)c1ccc(N(C)C)nc1.
What is the InChIKey of 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The InChIKey is QGZJVBXNFSLXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9(13-2)7-15-12(17)10-5-6-11(14-8-10)16(3)4/h5-6,8-9,13H,7H2,1-4H3,(H,15,17).
What are the key properties of 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 120828209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).