5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide

C14H23ClN4O — CID 107252414

IUPAC5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H23ClN4O/c1-4-19(5-2)8-6-7-11(3)18-14(20)12-9-17-13(15)10-16-12/h9-11H,4-8H2,1-3H3,(H,18,20)
InChIKeyWDXVEBFTKFDFGD-UHFFFAOYSA-N
MW298.82 g/mol
LogP2.37
Rot. Bonds8

About 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide

5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide (PubChem CID 107252414) has the molecular formula C14H23ClN4O and a molecular weight of 298.82 g/mol. Its IUPAC name is 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide
PubChem CID107252414
Molecular FormulaC14H23ClN4O
Molecular Weight298.82 g/mol
Exact Mass298.16
IUPAC Name5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H23ClN4O/c1-4-19(5-2)8-6-7-11(3)18-14(20)12-9-17-13(15)10-16-12/h9-11H,4-8H2,1-3H3,(H,18,20)
InChIKeyWDXVEBFTKFDFGD-UHFFFAOYSA-N
XLogP2.37
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.82
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[4-(dimethylamino)butan-2-yl]pyrazine-2-carboxamide
CID 107257919
6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 38988276
5-chloro-N-[(2S)-1-hydroxypropan-2-yl]pyrazine-2-carboxamide
CID 107258262
N-[5-(diethylamino)pentan-2-yl]-2H-triazole-4-carboxamide
CID 78968205
5-chloro-N-(4-methylsulfanylbutan-2-yl)pyrazine-2-carboxamide
CID 107257777
5-chloro-N-[1-(diethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 107371850
5-chloro-N-(1-hydroxyhexan-2-yl)pyrazine-2-carboxamide
CID 122604026
6-amino-N-[5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 62153221
N-[5-(diethylamino)pentan-2-yl]-4-hydrazinylpyridine-2-carboxamide
CID 62236182
5-chloro-N-(1-hydroxypentan-3-yl)pyrazine-2-carboxamide
CID 107258073
2-[(5-chloropyrazine-2-carbonyl)amino]propanoic acid
CID 107371387
5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 107249224

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide (CID 107252414) is 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide is CCN(CC)CCCC(C)NC(=O)c1cnc(Cl)cn1.
What is the InChIKey of 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide?
The InChIKey is WDXVEBFTKFDFGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN4O/c1-4-19(5-2)8-6-7-11(3)18-14(20)12-9-17-13(15)10-16-12/h9-11H,4-8H2,1-3H3,(H,18,20).
What are the key properties of 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide?
5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide has a molecular weight of 298.82 g/mol, XLogP of 2.37, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 107252414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).