6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide

C11H16N4O2 — CID 113411051

IUPAC6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide
SMILESCCNC(=O)CCNC(=O)c1ccc(N)nc1
InChIInChI=1S/C11H16N4O2/c1-2-13-10(16)5-6-14-11(17)8-3-4-9(12)15-7-8/h3-4,7H,2,5-6H2,1H3,(H2,12,15)(H,13,16)(H,14,17)
InChIKeyBZWFVNLXANLWBE-UHFFFAOYSA-N
MW236.28 g/mol
LogP-0.08
Rot. Bonds5

About 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide

6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide (PubChem CID 113411051) has the molecular formula C11H16N4O2 and a molecular weight of 236.28 g/mol. Its IUPAC name is 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide
PubChem CID113411051
Molecular FormulaC11H16N4O2
Molecular Weight236.28 g/mol
Exact Mass236.13
IUPAC Name6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide
SMILESCCNC(=O)CCNC(=O)c1ccc(N)nc1
InChIInChI=1S/C11H16N4O2/c1-2-13-10(16)5-6-14-11(17)8-3-4-9(12)15-7-8/h3-4,7H,2,5-6H2,1H3,(H2,12,15)(H,13,16)(H,14,17)
InChIKeyBZWFVNLXANLWBE-UHFFFAOYSA-N
XLogP-0.08
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-ethylpyridine-3-carboxamide
CID 62073744
6-amino-N-(5-amino-5-oxopentyl)pyridine-3-carboxamide
CID 114162800
6-amino-N-[2-[ethyl(propyl)amino]ethyl]pyridine-3-carboxamide
CID 114134937
6-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 114134948
6-amino-N-(2,2-dimethylbutyl)pyridine-3-carboxamide
CID 103464702
6-amino-N-[2-[11-[4-(methylamino)phenyl]undecanoylamino]ethyl]pyridine-3-carboxamide
CID 143014726
2-[4-(6-aminopyridine-3-carbonyl)piperazin-1-yl]-N-ethylacetamide
CID 72857433
6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 62072605
6-amino-N-(2-ethoxy-2-methylpropyl)pyridine-3-carboxamide
CID 114944068
N-[3-(ethylamino)-3-oxopropyl]-4-hydrazinyl-3-methylbenzamide
CID 113411061
6-amino-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-3-carboxamide
CID 70906155
6-amino-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62313054

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide (CID 113411051) is 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide is CCNC(=O)CCNC(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide?
The InChIKey is BZWFVNLXANLWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-2-13-10(16)5-6-14-11(17)8-3-4-9(12)15-7-8/h3-4,7H,2,5-6H2,1H3,(H2,12,15)(H,13,16)(H,14,17).
What are the key properties of 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide?
6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide has a molecular weight of 236.28 g/mol, XLogP of -0.08, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[3-(ethylamino)-3-oxopropyl]pyridine-3-carboxamide is sourced from PubChem (CID 113411051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).