N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide

C15H23N3O — CID 107401262

IUPACN-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)N(CC)CC2CCC2)n1
InChIInChI=1S/C15H23N3O/c1-3-16-14-10-6-9-13(17-14)15(19)18(4-2)11-12-7-5-8-12/h6,9-10,12H,3-5,7-8,11H2,1-2H3,(H,16,17)
InChIKeyFIDZMCUACHRRIC-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds6

About N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide

N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide (PubChem CID 107401262) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide
PubChem CID107401262
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)N(CC)CC2CCC2)n1
InChIInChI=1S/C15H23N3O/c1-3-16-14-10-6-9-13(17-14)15(19)18(4-2)11-12-7-5-8-12/h6,9-10,12H,3-5,7-8,11H2,1-2H3,(H,16,17)
InChIKeyFIDZMCUACHRRIC-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide (CID 107401262) is N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide is CCNc1cccc(C(=O)N(CC)CC2CCC2)n1.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide?
The InChIKey is FIDZMCUACHRRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-16-14-10-6-9-13(17-14)15(19)18(4-2)11-12-7-5-8-12/h6,9-10,12H,3-5,7-8,11H2,1-2H3,(H,16,17).
What are the key properties of N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide?
N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 107401262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).