5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

C21H28N4O3 — CID 109229683

IUPAC5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cncc(NCCN3CCOCC3)c2)cc1
InChIInChI=1S/C21H28N4O3/c1-16(2)28-20-5-3-18(4-6-20)24-21(26)17-13-19(15-22-14-17)23-7-8-25-9-11-27-12-10-25/h3-6,13-16,23H,7-12H2,1-2H3,(H,24,26)
InChIKeyUMUOPAVRAFVBSA-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.87
Rot. Bonds8

About 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (PubChem CID 109229683) has the molecular formula C21H28N4O3 and a molecular weight of 384.48 g/mol. Its IUPAC name is 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
PubChem CID109229683
Molecular FormulaC21H28N4O3
Molecular Weight384.48 g/mol
Exact Mass384.22
IUPAC Name5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cncc(NCCN3CCOCC3)c2)cc1
InChIInChI=1S/C21H28N4O3/c1-16(2)28-20-5-3-18(4-6-20)24-21(26)17-13-19(15-22-14-17)23-7-8-25-9-11-27-12-10-25/h3-6,13-16,23H,7-12H2,1-2H3,(H,24,26)
InChIKeyUMUOPAVRAFVBSA-UHFFFAOYSA-N
XLogP2.87
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-tert-butylphenyl)-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229662
N-[4-(dimethylamino)phenyl]-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229697
5-(2-morpholin-4-ylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223173
2-methyl-6-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyrimidine-4-carboxamide
CID 109366422
N-(2-ethylphenyl)-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229652
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxybenzamide
CID 6471257
N-cycloheptyl-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 102253634
3,4-dimethoxy-N-[4-(2-morpholin-4-ylethylamino)phenyl]benzamide
CID 112981431
5-(furan-2-ylmethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231569
N-methyl-5-(2-morpholin-4-ylethylamino)-N-phenylpyridine-3-carboxamide
CID 109229643
N-[3-(dimethylamino)propyl]-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229586
5-(2,6-dimethylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109243191

Frequently Asked Questions

What is the IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (CID 109229683) is 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is CC(C)Oc1ccc(NC(=O)c2cncc(NCCN3CCOCC3)c2)cc1.
What is the InChIKey of 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The InChIKey is UMUOPAVRAFVBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O3/c1-16(2)28-20-5-3-18(4-6-20)24-21(26)17-13-19(15-22-14-17)23-7-8-25-9-11-27-12-10-25/h3-6,13-16,23H,7-12H2,1-2H3,(H,24,26).
What are the key properties of 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 2.87, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-morpholin-4-ylethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109229683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).