2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide

C16H20N4O — CID 63180905

IUPAC2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccnc(N)c2)cc1
InChIInChI=1S/C16H20N4O/c1-3-20(4-2)14-7-5-13(6-8-14)19-16(21)12-9-10-18-15(17)11-12/h5-11H,3-4H2,1-2H3,(H2,17,18)(H,19,21)
InChIKeyNTQWDDFMRFWFIZ-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.76
Rot. Bonds5

About 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide

2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide (PubChem CID 63180905) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
PubChem CID63180905
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccnc(N)c2)cc1
InChIInChI=1S/C16H20N4O/c1-3-20(4-2)14-7-5-13(6-8-14)19-16(21)12-9-10-18-15(17)11-12/h5-11H,3-4H2,1-2H3,(H2,17,18)(H,19,21)
InChIKeyNTQWDDFMRFWFIZ-UHFFFAOYSA-N
XLogP2.76
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-anilino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
CID 109176141
2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 62154696
4-N-[4-(diethylamino)phenyl]-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109090596
N-[4-(diethylamino)phenyl]-2-(2-methylanilino)pyridine-4-carboxamide
CID 109176212
3-amino-N-[4-(diethylamino)phenyl]-4-methylbenzamide
CID 28723656
N-[4-(diethylamino)phenyl]-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109170697
2-N-[4-(diethylamino)phenyl]-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090511
N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109169732
N-[4-(diethylamino)phenyl]-3-methylbenzamide
CID 835431
N-[4-(diethylamino)phenyl]-2H-benzotriazole-5-carboxamide
CID 17460824
N-[4-(diethylamino)phenyl]-3-(dimethylamino)benzamide
CID 8761945
N-[4-(diethylamino)phenyl]-3-iodobenzamide
CID 2665797

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide (CID 63180905) is 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide is CCN(CC)c1ccc(NC(=O)c2ccnc(N)c2)cc1.
What is the InChIKey of 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide?
The InChIKey is NTQWDDFMRFWFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-3-20(4-2)14-7-5-13(6-8-14)19-16(21)12-9-10-18-15(17)11-12/h5-11H,3-4H2,1-2H3,(H2,17,18)(H,19,21).
What are the key properties of 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide?
2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 63180905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).