N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide

C16H24N4O3 — CID 113000312

IUPACN-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
SMILESCC(C)NC(=O)NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C16H24N4O3/c1-12(2)18-16(22)17-11-15(21)19-13-5-3-4-6-14(13)20-7-9-23-10-8-20/h3-6,12H,7-11H2,1-2H3,(H,19,21)(H2,17,18,22)
InChIKeyMTSARMNOXBQACD-UHFFFAOYSA-N
MW320.39 g/mol
LogP1.17
Rot. Bonds5

About N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide

N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide (PubChem CID 113000312) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
PubChem CID113000312
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC NameN-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
SMILESCC(C)NC(=O)NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C16H24N4O3/c1-12(2)18-16(22)17-11-15(21)19-13-5-3-4-6-14(13)20-7-9-23-10-8-20/h3-6,12H,7-11H2,1-2H3,(H,19,21)(H2,17,18,22)
InChIKeyMTSARMNOXBQACD-UHFFFAOYSA-N
XLogP1.17
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylbutylamino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109005860
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109007545
N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 113000271
(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide
CID 8005269
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
2-(2-fluorophenyl)-N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]acetamide
CID 113000301
1-(2-morpholin-4-ylphenyl)-3-pentan-3-ylurea
CID 108888338
3-(ethylamino)-N-(2-morpholin-4-ylphenyl)butanamide
CID 62839891
2-[(2-methylphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 108996603
2-(2-bromoanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109010619

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide?
The IUPAC name of N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide (CID 113000312) is N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide.
What is the SMILES notation for N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide?
The canonical SMILES for N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide is CC(C)NC(=O)NCC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide?
The InChIKey is MTSARMNOXBQACD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-12(2)18-16(22)17-11-15(21)19-13-5-3-4-6-14(13)20-7-9-23-10-8-20/h3-6,12H,7-11H2,1-2H3,(H,19,21)(H2,17,18,22).
What are the key properties of N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide?
N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide has a molecular weight of 320.39 g/mol, XLogP of 1.17, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide is sourced from PubChem (CID 113000312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).