2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide

C13H20N4O — CID 55244733

IUPAC2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide
SMILESCCN(c1cc(C(N)=O)ccn1)C1CCCNC1
InChIInChI=1S/C13H20N4O/c1-2-17(11-4-3-6-15-9-11)12-8-10(13(14)18)5-7-16-12/h5,7-8,11,15H,2-4,6,9H2,1H3,(H2,14,18)
InChIKeyRLFLWHLSJGCBJA-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.76
Rot. Bonds4

About 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide

2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide (PubChem CID 55244733) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide
PubChem CID55244733
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide
SMILESCCN(c1cc(C(N)=O)ccn1)C1CCCNC1
InChIInChI=1S/C13H20N4O/c1-2-17(11-4-3-6-15-9-11)12-8-10(13(14)18)5-7-16-12/h5,7-8,11,15H,2-4,6,9H2,1H3,(H2,14,18)
InChIKeyRLFLWHLSJGCBJA-UHFFFAOYSA-N
XLogP0.76
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[ethyl(piperidin-3-yl)amino]pyridine-3-carboxamide
CID 63637691
methyl 2-[azetidin-3-yl(ethyl)amino]pyridine-4-carboxylate
CID 114075171
3-chloro-4-[piperidin-3-yl(propyl)amino]benzamide
CID 63636499
5-bromo-2-[ethyl(piperidin-3-yl)amino]benzamide
CID 114893995
2-bromo-4-[ethyl(piperidin-3-yl)amino]benzamide
CID 107280707
3-bromo-4-[ethyl(pyrrolidin-3-yl)amino]benzamide
CID 82808855
N-ethyl-4-methyl-N-piperidin-3-ylpyrimidin-2-amine
CID 63637344
2-chloro-6-[ethyl(piperidin-3-yl)amino]benzamide
CID 63638436
2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carboxamide
CID 106618863
N-ethyl-N-piperidin-3-ylpyridazine-4-carboxamide
CID 104671440
3-fluoro-4-[[methyl(piperidin-3-yl)amino]methyl]benzamide
CID 63642494
4-[ethyl(pyrrolidin-3-yl)amino]-3-nitrobenzamide
CID 63299887

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide?
The IUPAC name of 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide (CID 55244733) is 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide?
The canonical SMILES for 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide is CCN(c1cc(C(N)=O)ccn1)C1CCCNC1.
What is the InChIKey of 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide?
The InChIKey is RLFLWHLSJGCBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-17(11-4-3-6-15-9-11)12-8-10(13(14)18)5-7-16-12/h5,7-8,11,15H,2-4,6,9H2,1H3,(H2,14,18).
What are the key properties of 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide?
2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(piperidin-3-yl)amino]pyridine-4-carboxamide is sourced from PubChem (CID 55244733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).