N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide

C19H25N3O — CID 113037354

IUPACN-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCCN(c1ccc(NC(=O)C(C)(C)C)nc1)c1cccc(C)c1
InChIInChI=1S/C19H25N3O/c1-6-22(15-9-7-8-14(2)12-15)16-10-11-17(20-13-16)21-18(23)19(3,4)5/h7-13H,6H2,1-5H3,(H,20,21,23)
InChIKeyNBNSRCQQRFUJJG-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.53
Rot. Bonds4

About N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide

N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide (PubChem CID 113037354) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide
PubChem CID113037354
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC NameN-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCCN(c1ccc(NC(=O)C(C)(C)C)nc1)c1cccc(C)c1
InChIInChI=1S/C19H25N3O/c1-6-22(15-9-7-8-14(2)12-15)16-10-11-17(20-13-16)21-18(23)19(3,4)5/h7-13H,6H2,1-5H3,(H,20,21,23)
InChIKeyNBNSRCQQRFUJJG-UHFFFAOYSA-N
XLogP4.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-3-propan-2-ylurea
CID 113037388
N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2-phenylacetamide
CID 113037370
2-amino-N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]propanamide
CID 82034854
N-tert-butyl-5-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109195162
N-(4-acetylphenyl)-5-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109200389
5-(N-ethyl-3-methylanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181194
N-[4-(dimethylamino)phenyl]-5-(N-ethyl-3-methylanilino)pyridine-3-carboxamide
CID 109246001
N-[3-(dimethylamino)propyl]-5-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109186079
6-(N-ethyl-3-methylanilino)pyridine-3-carboxylic acid
CID 61101859
5-chloro-6-(N-ethyl-3-methylanilino)pyridine-3-carboxylic acid
CID 63539159
2-(N-ethyl-3-methylanilino)-N-(4-methylphenyl)pyrimidine-5-carboxamide
CID 109265763
2,2-dimethyl-N-[6-(propanoylamino)-3-pyridinyl]propanamide
CID 1452729

Frequently Asked Questions

What is the IUPAC name of N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide (CID 113037354) is N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide is CCN(c1ccc(NC(=O)C(C)(C)C)nc1)c1cccc(C)c1.
What is the InChIKey of N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide?
The InChIKey is NBNSRCQQRFUJJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-6-22(15-9-7-8-14(2)12-15)16-10-11-17(20-13-16)21-18(23)19(3,4)5/h7-13H,6H2,1-5H3,(H,20,21,23).
What are the key properties of N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide?
N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide has a molecular weight of 311.43 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 113037354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).