N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide

C19H25N3O2 — CID 109238819

IUPACN,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(Nc2ccccc2OC(C)C)c1
InChIInChI=1S/C19H25N3O2/c1-5-22(6-2)19(23)15-11-16(13-20-12-15)21-17-9-7-8-10-18(17)24-14(3)4/h7-14,21H,5-6H2,1-4H3
InChIKeyMVKUKQYFSFQPIK-UHFFFAOYSA-N
MW327.43 g/mol
LogP4.09
Rot. Bonds7

About N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide

N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide (PubChem CID 109238819) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
PubChem CID109238819
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(Nc2ccccc2OC(C)C)c1
InChIInChI=1S/C19H25N3O2/c1-5-22(6-2)19(23)15-11-16(13-20-12-15)21-17-9-7-8-10-18(17)24-14(3)4/h7-14,21H,5-6H2,1-4H3
InChIKeyMVKUKQYFSFQPIK-UHFFFAOYSA-N
XLogP4.09
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-diethyl-5-(2-methoxyanilino)pyridine-3-carboxamide
CID 109238813
N-benzyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109231733
N-(3-methoxypropyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109228125
5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109245387
5-(2-tert-butylanilino)-N,N-diethylpyridine-3-carboxamide
CID 109238796
N-[(3-methylphenyl)methyl]-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109232306
5-(2,3-dimethylanilino)-N,N-diethylpyridine-3-carboxamide
CID 109238786
N-(oxolan-2-ylmethyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109228849
N-cyclohexyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109226755
N,N-diethyl-5-(4-phenoxyanilino)pyridine-3-carboxamide
CID 109238844
5-(5-chloro-2-methoxyanilino)-N,N-diethylpyridine-3-carboxamide
CID 109238810

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide (CID 109238819) is N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide is CCN(CC)C(=O)c1cncc(Nc2ccccc2OC(C)C)c1.
What is the InChIKey of N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
The InChIKey is MVKUKQYFSFQPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-5-22(6-2)19(23)15-11-16(13-20-12-15)21-17-9-7-8-10-18(17)24-14(3)4/h7-14,21H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide?
N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109238819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).