4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

C20H26N4O2 — CID 109207508

IUPAC4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCc1cc(C)cc(Nc2ccnc(C(=O)NCCN3CCOCC3)c2)c1
InChIInChI=1S/C20H26N4O2/c1-15-11-16(2)13-18(12-15)23-17-3-4-21-19(14-17)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14H,5-10H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyOQSDAAHGHCHZJJ-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.50
Rot. Bonds6

About 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 109207508) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
PubChem CID109207508
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCc1cc(C)cc(Nc2ccnc(C(=O)NCCN3CCOCC3)c2)c1
InChIInChI=1S/C20H26N4O2/c1-15-11-16(2)13-18(12-15)23-17-3-4-21-19(14-17)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14H,5-10H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyOQSDAAHGHCHZJJ-UHFFFAOYSA-N
XLogP2.50
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,6-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207509
4-(2-methylpropylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109203053
4-amino-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 62156261
4-(2,4-difluoroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207564
4-(cycloheptylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207488
4-(2,4-dimethoxyanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207544
4-hydrazinyl-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
CID 62243174
4-(furan-2-ylmethylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207450
4-(dipropylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207495
2-N-(3-methylbutyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083732
N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 977791
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109078417

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (CID 109207508) is 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is Cc1cc(C)cc(Nc2ccnc(C(=O)NCCN3CCOCC3)c2)c1.
What is the InChIKey of 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is OQSDAAHGHCHZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-15-11-16(2)13-18(12-15)23-17-3-4-21-19(14-17)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14H,5-10H2,1-2H3,(H,21,23)(H,22,25).
What are the key properties of 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109207508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).