N,N-diethylpyridine-3-carboxamide

C10H14N2O — CID 5497

💊View drug profile → nikethamide
IUPACN,N-diethylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cccnc1
InChIInChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3
InChIKeyNCYVXEGFNDZQCU-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.56
Rot. Bonds3

About N,N-diethylpyridine-3-carboxamide

N,N-diethylpyridine-3-carboxamide (PubChem CID 5497) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is N,N-diethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethylpyridine-3-carboxamide
PubChem CID5497
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC NameN,N-diethylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cccnc1
InChIInChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3
InChIKeyNCYVXEGFNDZQCU-UHFFFAOYSA-N
XLogP1.56
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Nicotinamide
CID 936
Nicorandil
CID 47528
4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanone
CID 47289
Flonicamid
CID 9834513
3-Pyridinecarboxaldehyde
CID 10371
3-Acetylpyridine
CID 9589
6-Aminonicotinamide
CID 9500
N'-Methylnicotinamide
CID 64950
1-Methylnicotinamide
CID 457
Isonicotinamide
CID 15074
Nicotinohydroxamic acid
CID 71211
Nicotinuric Acid
CID 68499

Frequently Asked Questions

What is the IUPAC name of N,N-diethylpyridine-3-carboxamide?
The IUPAC name of N,N-diethylpyridine-3-carboxamide (CID 5497) is N,N-diethylpyridine-3-carboxamide.
What is the SMILES notation for N,N-diethylpyridine-3-carboxamide?
The canonical SMILES for N,N-diethylpyridine-3-carboxamide is CCN(CC)C(=O)c1cccnc1.
What is the InChIKey of N,N-diethylpyridine-3-carboxamide?
The InChIKey is NCYVXEGFNDZQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3.
What are the key properties of N,N-diethylpyridine-3-carboxamide?
N,N-diethylpyridine-3-carboxamide has a molecular weight of 178.24 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylpyridine-3-carboxamide is sourced from PubChem (CID 5497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).