6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide

C19H24N4O2 — CID 109154486

IUPAC6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)NCCCN(C)C)cn2)cc1
InChIInChI=1S/C19H24N4O2/c1-14(24)15-5-8-17(9-6-15)22-18-10-7-16(13-21-18)19(25)20-11-4-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,20,25)(H,21,22)
InChIKeyAHAKNBADGFZJOF-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.71
Rot. Bonds8

About 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide

6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide (PubChem CID 109154486) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
PubChem CID109154486
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)NCCCN(C)C)cn2)cc1
InChIInChI=1S/C19H24N4O2/c1-14(24)15-5-8-17(9-6-15)22-18-10-7-16(13-21-18)19(25)20-11-4-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,20,25)(H,21,22)
InChIKeyAHAKNBADGFZJOF-UHFFFAOYSA-N
XLogP2.71
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(dimethylamino)propyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109154437
6-(4-cyanoanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109154528
6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109154509
6-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109153720
N-[3-(dimethylamino)propyl]-6-(2-ethylanilino)pyridine-3-carboxamide
CID 109154445
2-(4-acetamidoanilino)-N-[3-(dimethylamino)propyl]pyrimidine-5-carboxamide
CID 109253432
6-(3-bromo-4-methylanilino)-N-[2-(dimethylamino)ethyl]pyridine-3-carboxamide
CID 109153921
6-(4-bromo-2-methylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109154506
2-(4-acetamidoanilino)-N-[3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 109168260
N-[3-(dimethylamino)propyl]-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109154394
6-[4-(dimethylamino)anilino]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109153070
N-(4-acetylphenyl)-2-[3-(dimethylamino)propylamino]pyrimidine-5-carboxamide
CID 109253599

Frequently Asked Questions

What is the IUPAC name of 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide?
The IUPAC name of 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide (CID 109154486) is 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide is CC(=O)c1ccc(Nc2ccc(C(=O)NCCCN(C)C)cn2)cc1.
What is the InChIKey of 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide?
The InChIKey is AHAKNBADGFZJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14(24)15-5-8-17(9-6-15)22-18-10-7-16(13-21-18)19(25)20-11-4-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,20,25)(H,21,22).
What are the key properties of 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide?
6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.71, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-acetylanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 109154486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).