4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide

C16H19N3O — CID 106937157

IUPAC4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide
SMILESCCNc1ccc(C(=O)N(C)c2ccncc2)cc1C
InChIInChI=1S/C16H19N3O/c1-4-18-15-6-5-13(11-12(15)2)16(20)19(3)14-7-9-17-10-8-14/h5-11,18H,4H2,1-3H3
InChIKeyYVFJKCACGWPUSY-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.10
Rot. Bonds4

About 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide

4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide (PubChem CID 106937157) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide
PubChem CID106937157
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide
SMILESCCNc1ccc(C(=O)N(C)c2ccncc2)cc1C
InChIInChI=1S/C16H19N3O/c1-4-18-15-6-5-13(11-12(15)2)16(20)19(3)14-7-9-17-10-8-14/h5-11,18H,4H2,1-3H3
InChIKeyYVFJKCACGWPUSY-UHFFFAOYSA-N
XLogP3.10
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-(ethylamino)-3-methyl-N-pyridin-4-ylbenzamide
CID 106937429
2-(ethylamino)-N-methyl-N-pyridin-4-ylbenzamide
CID 106936402
4-(ethylamino)-N-methyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 81242334
N-ethyl-4-(ethylamino)-N-(2-hydroxy-2-methylpropyl)-3-methylbenzamide
CID 79386429
methyl 4-(ethylamino)-3-methylbenzoate
CID 43730612
N-[2-(dimethylamino)propyl]-4-(ethylamino)-3-methylbenzamide
CID 63213540
N,3-dimethyl-4-(propylamino)-N-pyridin-2-ylbenzamide
CID 63210004
N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63209750
N-cyclopropyl-4-(ethylamino)-3-methyl-N-propylbenzamide
CID 63210133
4-(ethylamino)-N-(2-hydroxy-3-methoxypropyl)-N,3-dimethylbenzamide
CID 63213865
3-chloro-4-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
CID 106936060
3-(ethylamino)-N-(4-fluorophenyl)-N-methylpyridine-4-carboxamide
CID 105069144

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide (CID 106937157) is 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide is CCNc1ccc(C(=O)N(C)c2ccncc2)cc1C.
What is the InChIKey of 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide?
The InChIKey is YVFJKCACGWPUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-4-18-15-6-5-13(11-12(15)2)16(20)19(3)14-7-9-17-10-8-14/h5-11,18H,4H2,1-3H3.
What are the key properties of 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide?
4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide has a molecular weight of 269.35 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N,3-dimethyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 106937157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).