acetic acid;N-ethylpyridine-2-carboxamide

C10H14N2O3 — CID 174901243

IUPACacetic acid;N-ethylpyridine-2-carboxamide
SMILESCC(=O)O.CCNC(=O)c1ccccn1
InChIInChI=1S/C8H10N2O.C2H4O2/c1-2-9-8(11)7-5-3-4-6-10-7;1-2(3)4/h3-6H,2H2,1H3,(H,9,11);1H3,(H,3,4)
InChIKeyRKDYFJABYWDXOC-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.92
Rot. Bonds2

About acetic acid;N-ethylpyridine-2-carboxamide

acetic acid;N-ethylpyridine-2-carboxamide (PubChem CID 174901243) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is acetic acid;N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Nameacetic acid;N-ethylpyridine-2-carboxamide
PubChem CID174901243
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Nameacetic acid;N-ethylpyridine-2-carboxamide
SMILESCC(=O)O.CCNC(=O)c1ccccn1
InChIInChI=1S/C8H10N2O.C2H4O2/c1-2-9-8(11)7-5-3-4-6-10-7;1-2(3)4/h3-6H,2H2,1H3,(H,9,11);1H3,(H,3,4)
InChIKeyRKDYFJABYWDXOC-UHFFFAOYSA-N
XLogP0.92
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(diethylamino)-2-phenylethyl]pyridine-2-carboxamide
CID 42917068
N-phenacylpyridine-2-carboxamide
CID 64991609
N-[(2R)-2-phenylpropyl]pyridine-2-carboxamide
CID 9302014
N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-(2-bromoethyl)pyridine-2-carboxamide
CID 12983473
N-[2-[methyl-[2-(pyridine-2-carbonylamino)ethyl]amino]ethyl]pyridine-2-carboxamide
CID 15495474
N-[(2S)-2-(ethylamino)-3-oxopentyl]pyridine-2-carboxamide
CID 162019589
2-(pyridine-2-carbonylamino)acetic acid;thiophene
CID 66951625
(E)-but-2-enedioic acid;N-[3-[3-(pyridine-2-carbonylamino)propylamino]propyl]pyridine-2-carboxamide
CID 155880885
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
N-(2-methylbutan-2-yl)pyridine-2-carboxamide
CID 39902982
N-ethyl-5-pyridin-2-yl-1,2-oxazole-3-carboxamide
CID 155273411

Frequently Asked Questions

What is the IUPAC name of acetic acid;N-ethylpyridine-2-carboxamide?
The IUPAC name of acetic acid;N-ethylpyridine-2-carboxamide (CID 174901243) is acetic acid;N-ethylpyridine-2-carboxamide.
What is the SMILES notation for acetic acid;N-ethylpyridine-2-carboxamide?
The canonical SMILES for acetic acid;N-ethylpyridine-2-carboxamide is CC(=O)O.CCNC(=O)c1ccccn1.
What is the InChIKey of acetic acid;N-ethylpyridine-2-carboxamide?
The InChIKey is RKDYFJABYWDXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O.C2H4O2/c1-2-9-8(11)7-5-3-4-6-10-7;1-2(3)4/h3-6H,2H2,1H3,(H,9,11);1H3,(H,3,4).
What are the key properties of acetic acid;N-ethylpyridine-2-carboxamide?
acetic acid;N-ethylpyridine-2-carboxamide has a molecular weight of 210.23 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 174901243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).