2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide

C15H17N3O — CID 106934342

IUPAC2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide
SMILESCCN(C(=O)c1c(C)cccc1N)c1ccncc1
InChIInChI=1S/C15H17N3O/c1-3-18(12-7-9-17-10-8-12)15(19)14-11(2)5-4-6-13(14)16/h4-10H,3,16H2,1-2H3
InChIKeyVFACZKIYGGQSAD-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.64
Rot. Bonds3

About 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide

2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide (PubChem CID 106934342) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide
PubChem CID106934342
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide
SMILESCCN(C(=O)c1c(C)cccc1N)c1ccncc1
InChIInChI=1S/C15H17N3O/c1-3-18(12-7-9-17-10-8-12)15(19)14-11(2)5-4-6-13(14)16/h4-10H,3,16H2,1-2H3
InChIKeyVFACZKIYGGQSAD-UHFFFAOYSA-N
XLogP2.64
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-3-hydroxy-2-methyl-N-pyridin-4-ylbenzamide
CID 106936106
2-amino-N-ethyl-6-methyl-N-propylbenzamide
CID 43268247
pyridin-4-ylmethyl 2-amino-6-methylbenzoate
CID 61323419
2-amino-N-ethyl-N-(4-fluorophenyl)-6-methoxybenzamide
CID 81393771
2-amino-N,6-dimethyl-N-pentan-3-ylbenzamide
CID 43570574
2-amino-N-ethyl-3-nitro-N-pyridin-4-ylbenzamide
CID 103733862
2-amino-N-(cyclopropylmethyl)-N-ethyl-6-methylbenzamide
CID 63954074
(2R)-2-amino-N-ethyl-N-pyridin-4-ylpropanamide
CID 106935605
4-amino-N,5-diethyl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
CID 106934374
3-bromo-N-ethyl-5-methyl-N-pyridin-4-ylbenzamide
CID 104854747
N-ethyl-4-(ethylamino)-3-methyl-N-pyridin-4-ylbenzamide
CID 106937429
4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
CID 106934373

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide (CID 106934342) is 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide is CCN(C(=O)c1c(C)cccc1N)c1ccncc1.
What is the InChIKey of 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide?
The InChIKey is VFACZKIYGGQSAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-18(12-7-9-17-10-8-12)15(19)14-11(2)5-4-6-13(14)16/h4-10H,3,16H2,1-2H3.
What are the key properties of 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide?
2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide has a molecular weight of 255.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 106934342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).