N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide

C15H17N3O — CID 115268582

IUPACN-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
SMILESCCNc1ccc(NC(=O)c2ccc(C)cc2)cn1
InChIInChI=1S/C15H17N3O/c1-3-16-14-9-8-13(10-17-14)18-15(19)12-6-4-11(2)5-7-12/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyFAYFMCOJGIYLHA-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.07
Rot. Bonds4

About N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide

N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide (PubChem CID 115268582) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
PubChem CID115268582
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
SMILESCCNc1ccc(NC(=O)c2ccc(C)cc2)cn1
InChIInChI=1S/C15H17N3O/c1-3-16-14-9-8-13(10-17-14)18-15(19)12-6-4-11(2)5-7-12/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyFAYFMCOJGIYLHA-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide?
The IUPAC name of N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide (CID 115268582) is N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide.
What is the SMILES notation for N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide?
The canonical SMILES for N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide is CCNc1ccc(NC(=O)c2ccc(C)cc2)cn1.
What is the InChIKey of N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide?
The InChIKey is FAYFMCOJGIYLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-16-14-9-8-13(10-17-14)18-15(19)12-6-4-11(2)5-7-12/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide?
N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide has a molecular weight of 255.32 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide is sourced from PubChem (CID 115268582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).