2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide

C14H21N3O — CID 113489132

IUPAC2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1(CC)CCC1
InChIInChI=1S/C14H21N3O/c1-3-14(8-6-9-14)17-13(18)11-7-5-10-16-12(11)15-4-2/h5,7,10H,3-4,6,8-9H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyRLSXEKLYRKXWQB-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.58
Rot. Bonds5

About 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide

2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide (PubChem CID 113489132) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide
PubChem CID113489132
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1(CC)CCC1
InChIInChI=1S/C14H21N3O/c1-3-14(8-6-9-14)17-13(18)11-7-5-10-16-12(11)15-4-2/h5,7,10H,3-4,6,8-9H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyRLSXEKLYRKXWQB-UHFFFAOYSA-N
XLogP2.58
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide (CID 113489132) is 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide is CCNc1ncccc1C(=O)NC1(CC)CCC1.
What is the InChIKey of 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide?
The InChIKey is RLSXEKLYRKXWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-14(8-6-9-14)17-13(18)11-7-5-10-16-12(11)15-4-2/h5,7,10H,3-4,6,8-9H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide?
2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-3-carboxamide is sourced from PubChem (CID 113489132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).