N-ethyl-3-(methylamino)pyridine-4-carboxamide

C9H13N3O — CID 105068179

IUPACN-ethyl-3-(methylamino)pyridine-4-carboxamide
SMILESCCNC(=O)c1ccncc1NC
InChIInChI=1S/C9H13N3O/c1-3-12-9(13)7-4-5-11-6-8(7)10-2/h4-6,10H,3H2,1-2H3,(H,12,13)
InChIKeyKIBAGCVPWCHYTI-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.87
Rot. Bonds3

About N-ethyl-3-(methylamino)pyridine-4-carboxamide

N-ethyl-3-(methylamino)pyridine-4-carboxamide (PubChem CID 105068179) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-ethyl-3-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(methylamino)pyridine-4-carboxamide
PubChem CID105068179
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-ethyl-3-(methylamino)pyridine-4-carboxamide
SMILESCCNC(=O)c1ccncc1NC
InChIInChI=1S/C9H13N3O/c1-3-12-9(13)7-4-5-11-6-8(7)10-2/h4-6,10H,3H2,1-2H3,(H,12,13)
InChIKeyKIBAGCVPWCHYTI-UHFFFAOYSA-N
XLogP0.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,4-N-diethylpyridine-3,4-dicarboxamide
CID 14527703
N-[2-(ethylsulfamoyl)ethyl]-3-(methylamino)pyridine-4-carboxamide
CID 106342578
3-(methylamino)-N-(2-methyl-2-methylsulfonylpropyl)pyridine-4-carboxamide
CID 105070655
N-[2-(dimethylamino)-2-methylpropyl]-3-(methylamino)pyridine-4-carboxamide
CID 105069666
3-(methylamino)-N-(2-methyl-3-methylsulfanylpropyl)pyridine-4-carboxamide
CID 105070238
N-(2,2-dimethylheptyl)-3-(methylamino)pyridine-4-carboxamide
CID 105070761
N-[(3-ethylthiophen-2-yl)methyl]-3-(methylamino)pyridine-4-carboxamide
CID 105070736
N-[(3-ethyl-2-pyridinyl)methyl]-3-(methylamino)pyridine-4-carboxamide
CID 105070941
N-[2-(ethylamino)-2-oxoethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072034
3-(methylamino)-N-[(4-propan-2-ylphenyl)methyl]pyridine-4-carboxamide
CID 105069426
N-(2,3-dimethoxypropyl)-3-(methylamino)pyridine-4-carboxamide
CID 114101845
N-ethyl-3-(trifluoromethyl)pyridine-4-carboxamide
CID 142421392

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-ethyl-3-(methylamino)pyridine-4-carboxamide (CID 105068179) is N-ethyl-3-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-3-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-3-(methylamino)pyridine-4-carboxamide is CCNC(=O)c1ccncc1NC.
What is the InChIKey of N-ethyl-3-(methylamino)pyridine-4-carboxamide?
The InChIKey is KIBAGCVPWCHYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-3-12-9(13)7-4-5-11-6-8(7)10-2/h4-6,10H,3H2,1-2H3,(H,12,13).
What are the key properties of N-ethyl-3-(methylamino)pyridine-4-carboxamide?
N-ethyl-3-(methylamino)pyridine-4-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).