N,N-diethyl-2,3-dihydropyridine-6-carboxamide

C10H16N2O — CID 123947366

IUPACN,N-diethyl-2,3-dihydropyridine-6-carboxamide
SMILESCCN(CC)C(=O)C1=NCCC=C1
InChIInChI=1S/C10H16N2O/c1-3-12(4-2)10(13)9-7-5-6-8-11-9/h5,7H,3-4,6,8H2,1-2H3
InChIKeyLRNXQKFJONIAMC-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.26
Rot. Bonds3

About N,N-diethyl-2,3-dihydropyridine-6-carboxamide

N,N-diethyl-2,3-dihydropyridine-6-carboxamide (PubChem CID 123947366) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N,N-diethyl-2,3-dihydropyridine-6-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2,3-dihydropyridine-6-carboxamide
PubChem CID123947366
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN,N-diethyl-2,3-dihydropyridine-6-carboxamide
SMILESCCN(CC)C(=O)C1=NCCC=C1
InChIInChI=1S/C10H16N2O/c1-3-12(4-2)10(13)9-7-5-6-8-11-9/h5,7H,3-4,6,8H2,1-2H3
InChIKeyLRNXQKFJONIAMC-UHFFFAOYSA-N
XLogP1.26
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2,3-dihydropyridine-6-carboxamide?
The IUPAC name of N,N-diethyl-2,3-dihydropyridine-6-carboxamide (CID 123947366) is N,N-diethyl-2,3-dihydropyridine-6-carboxamide.
What is the SMILES notation for N,N-diethyl-2,3-dihydropyridine-6-carboxamide?
The canonical SMILES for N,N-diethyl-2,3-dihydropyridine-6-carboxamide is CCN(CC)C(=O)C1=NCCC=C1.
What is the InChIKey of N,N-diethyl-2,3-dihydropyridine-6-carboxamide?
The InChIKey is LRNXQKFJONIAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-12(4-2)10(13)9-7-5-6-8-11-9/h5,7H,3-4,6,8H2,1-2H3.
What are the key properties of N,N-diethyl-2,3-dihydropyridine-6-carboxamide?
N,N-diethyl-2,3-dihydropyridine-6-carboxamide has a molecular weight of 180.25 g/mol, XLogP of 1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2,3-dihydropyridine-6-carboxamide is sourced from PubChem (CID 123947366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).