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

C15H26N4O — CID 120831653

IUPAC6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide
SMILESCCN(c1ccc(C(=O)NCC(C)NC)cn1)C(C)C
InChIInChI=1S/C15H26N4O/c1-6-19(11(2)3)14-8-7-13(10-17-14)15(20)18-9-12(4)16-5/h7-8,10-12,16H,6,9H2,1-5H3,(H,18,20)
InChIKeyVSKTWIMLPLUAJZ-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.65
Rot. Bonds7

About 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide

6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide (PubChem CID 120831653) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide
PubChem CID120831653
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide
SMILESCCN(c1ccc(C(=O)NCC(C)NC)cn1)C(C)C
InChIInChI=1S/C15H26N4O/c1-6-19(11(2)3)14-8-7-13(10-17-14)15(20)18-9-12(4)16-5/h7-8,10-12,16H,6,9H2,1-5H3,(H,18,20)
InChIKeyVSKTWIMLPLUAJZ-UHFFFAOYSA-N
XLogP1.65
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120828209
N-[(2R)-2-(ethylamino)propyl]-6-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 120652365
4-N,4-N-diethyl-1-N-[2-(methylamino)propyl]benzene-1,4-dicarboxamide
CID 120828485
6-(diethylamino)-N-(4-hydroxy-2-methylpentyl)pyridine-3-carboxamide
CID 111447882
6-(3,5-dimethylpyrazol-1-yl)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120827441
6-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)pyridine-3-carboxamide
CID 103771018
6-[ethyl(propan-2-yl)amino]-N'-hydroxypyridine-3-carboximidamide
CID 43265833
N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119996612
4-[ethyl(propyl)amino]-N-[2-(methylamino)propyl]benzamide
CID 120829950
N-(3-amino-2-methylpropyl)-6-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 119997079
2-[[[6-(dimethylamino)pyridine-3-carbonyl]amino]methyl]butanoic acid
CID 65219660
N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370

Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The IUPAC name of 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide (CID 120831653) is 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide is CCN(c1ccc(C(=O)NCC(C)NC)cn1)C(C)C.
What is the InChIKey of 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
The InChIKey is VSKTWIMLPLUAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-6-19(11(2)3)14-8-7-13(10-17-14)15(20)18-9-12(4)16-5/h7-8,10-12,16H,6,9H2,1-5H3,(H,18,20).
What are the key properties of 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide?
6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(propan-2-yl)amino]-N-[2-(methylamino)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 120831653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).