N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide

C14H20N4O2 — CID 63286908

IUPACN-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(CCC#N)CCOC)c1
InChIInChI=1S/C14H20N4O2/c1-3-16-12-5-7-17-13(11-12)14(19)18(8-4-6-15)9-10-20-2/h5,7,11H,3-4,8-10H2,1-2H3,(H,16,17)
InChIKeyCSCNVDQDBMATNY-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.52
Rot. Bonds8

About N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide

N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide (PubChem CID 63286908) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide
PubChem CID63286908
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(CCC#N)CCOC)c1
InChIInChI=1S/C14H20N4O2/c1-3-16-12-5-7-17-13(11-12)14(19)18(8-4-6-15)9-10-20-2/h5,7,11H,3-4,8-10H2,1-2H3,(H,16,17)
InChIKeyCSCNVDQDBMATNY-UHFFFAOYSA-N
XLogP1.52
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-(2-methoxyethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62176077
N-(2-cyanoethyl)-N-(2-methylpropyl)-4-(propylamino)pyridine-2-carboxamide
CID 62181706
N-(2-cyanoethyl)-5-hydrazinyl-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104642764
4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide
CID 62180315
3-chloro-N-(2-cyanoethyl)-6-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 63290108
4-(ethylamino)-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62180104
2-amino-N-(2-cyanoethyl)-3-fluoro-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 105386249
N-(2-cyanoethyl)-N-(2-methoxyethyl)-6-(methylamino)pyridine-3-carboxamide
CID 63286998
N-(2-cyanoethyl)-N-(2-methoxyethyl)-2,4,6-trimethylbenzamide
CID 63286185
N-(2-cyanoethyl)-N-(2-methoxyethyl)thiophene-3-carboxamide
CID 63237168
N-(2-cyanoethyl)-6-fluoro-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 63978805
N-(2-cyanoethyl)-N-(2-methoxyethyl)quinoxaline-5-carboxamide
CID 104578268

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide (CID 63286908) is N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide is CCNc1ccnc(C(=O)N(CCC#N)CCOC)c1.
What is the InChIKey of N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The InChIKey is CSCNVDQDBMATNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-3-16-12-5-7-17-13(11-12)14(19)18(8-4-6-15)9-10-20-2/h5,7,11H,3-4,8-10H2,1-2H3,(H,16,17).
What are the key properties of N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide?
N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.52, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 63286908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).