N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide

C18H21N3O4 — CID 2521701

IUPACN-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide
SMILESO=C(CCNC(=O)c1ccco1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H21N3O4/c22-17(7-8-19-18(23)16-6-3-11-25-16)20-14-4-1-2-5-15(14)21-9-12-24-13-10-21/h1-6,11H,7-10,12-13H2,(H,19,23)(H,20,22)
InChIKeyOGSLNSGVZNJMOO-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.87
Rot. Bonds6

About N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide

N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide (PubChem CID 2521701) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide
PubChem CID2521701
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide
SMILESO=C(CCNC(=O)c1ccco1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H21N3O4/c22-17(7-8-19-18(23)16-6-3-11-25-16)20-14-4-1-2-5-15(14)21-9-12-24-13-10-21/h1-6,11H,7-10,12-13H2,(H,19,23)(H,20,22)
InChIKeyOGSLNSGVZNJMOO-UHFFFAOYSA-N
XLogP1.87
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]thiophene-2-carboxamide
CID 51180135
N-(2-morpholin-4-ylphenyl)-3-(pyridin-4-ylmethylamino)propanamide
CID 109024044
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
N-[3-[2-(cyclopropylcarbamoyl)anilino]-3-oxopropyl]furan-2-carboxamide
CID 9451738
3-(2-tert-butylanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109037337
3-(3-aminophenyl)-N-(2-morpholin-4-ylphenyl)propanamide
CID 28713588
N-(2-morpholin-4-ylphenyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109037056
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
6-amino-N-(2-morpholin-4-ylphenyl)hexanamide
CID 43708115
N-(2-morpholin-4-ylphenyl)-3-piperidin-1-ylpropanamide
CID 110688369
N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide
CID 109036145
1-(2-morpholin-4-ylphenyl)-3-propylurea
CID 110755134

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide?
The IUPAC name of N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide (CID 2521701) is N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide?
The canonical SMILES for N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide is O=C(CCNC(=O)c1ccco1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide?
The InChIKey is OGSLNSGVZNJMOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c22-17(7-8-19-18(23)16-6-3-11-25-16)20-14-4-1-2-5-15(14)21-9-12-24-13-10-21/h1-6,11H,7-10,12-13H2,(H,19,23)(H,20,22).
What are the key properties of N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide?
N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-morpholin-4-ylanilino)-3-oxopropyl]furan-2-carboxamide is sourced from PubChem (CID 2521701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).