N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide

C19H24N4O2 — CID 109024044

IUPACN-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide
SMILESO=C(CCNCc1ccncc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C19H24N4O2/c24-19(7-10-21-15-16-5-8-20-9-6-16)22-17-3-1-2-4-18(17)23-11-13-25-14-12-23/h1-6,8-9,21H,7,10-15H2,(H,22,24)
InChIKeyNIPUUNPETYDUIB-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.04
Rot. Bonds7

About N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide

N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide (PubChem CID 109024044) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide
PubChem CID109024044
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide
SMILESO=C(CCNCc1ccncc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C19H24N4O2/c24-19(7-10-21-15-16-5-8-20-9-6-16)22-17-3-1-2-4-18(17)23-11-13-25-14-12-23/h1-6,8-9,21H,7,10-15H2,(H,22,24)
InChIKeyNIPUUNPETYDUIB-UHFFFAOYSA-N
XLogP2.04
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.04
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

3-[(2-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)propanamide
CID 109022218
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CID 43229589
N'-methyl-N-(2-morpholin-4-ylphenyl)-N'-(2-pyridin-4-ylethyl)propanediamide
CID 108948987
6-amino-N-(2-morpholin-4-ylphenyl)hexanamide
CID 43708115
N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide
CID 2521701
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
3-(2-tert-butylanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109037337
N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]thiophene-2-carboxamide
CID 51180135
2-[(3-methylphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 108996829
N-(2-morpholin-4-ylphenyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109037056
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
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N-(2-morpholin-4-ylphenyl)-3-piperidin-1-ylpropanamide
CID 110688369

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide?
The IUPAC name of N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide (CID 109024044) is N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide.
What is the SMILES notation for N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide?
The canonical SMILES for N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide is O=C(CCNCc1ccncc1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide?
The InChIKey is NIPUUNPETYDUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-19(7-10-21-15-16-5-8-20-9-6-16)22-17-3-1-2-4-18(17)23-11-13-25-14-12-23/h1-6,8-9,21H,7,10-15H2,(H,22,24).
What are the key properties of N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide?
N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide has a molecular weight of 340.43 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide is sourced from PubChem (CID 109024044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).