N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide

C16H26N4O — CID 114516097

IUPACN-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCCC2CCN(C)CC2)ccn1
InChIInChI=1S/C16H26N4O/c1-3-17-16(21)15-12-14(5-9-19-15)18-8-4-13-6-10-20(2)11-7-13/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyRYQSRIPLUKQSRF-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.98
Rot. Bonds6

About N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide

N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide (PubChem CID 114516097) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
PubChem CID114516097
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCCC2CCN(C)CC2)ccn1
InChIInChI=1S/C16H26N4O/c1-3-17-16(21)15-12-14(5-9-19-15)18-8-4-13-6-10-20(2)11-7-13/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyRYQSRIPLUKQSRF-UHFFFAOYSA-N
XLogP1.98
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide
CID 114516067
4-[2-[cyclopropyl(ethyl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 103739556
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
N-ethyl-4-[(3-hydroxycyclobutyl)methylamino]pyridine-2-carboxamide
CID 66004621
4-[2-[di(propan-2-yl)amino]ethylamino]-N-ethylpyridine-2-carboxamide
CID 43517863
4-(2-cyclopropylpropylamino)-N-ethylpyridine-2-carboxamide
CID 113234707
N-[2-(1-methylpiperidin-4-yl)ethyl]pyrazine-2-carboxamide
CID 141475460
N-(cyclobutylmethyl)-4-(ethylamino)pyridine-2-carboxamide
CID 62167949
4-(ethylamino)-N-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 83025254
N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
2-fluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-4-carboxamide
CID 115601906
4-(cycloheptylamino)-N-ethylpyridine-2-carboxamide
CID 43517906

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide (CID 114516097) is N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide is CCNC(=O)c1cc(NCCC2CCN(C)CC2)ccn1.
What is the InChIKey of N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide?
The InChIKey is RYQSRIPLUKQSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-17-16(21)15-12-14(5-9-19-15)18-8-4-13-6-10-20(2)11-7-13/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,17,21)(H,18,19).
What are the key properties of N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide?
N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[2-(1-methylpiperidin-4-yl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 114516097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).