N-(4-aminophenyl)-4-morpholin-4-ylbutanamide

C14H21N3O2 — CID 16779642

IUPACN-(4-aminophenyl)-4-morpholin-4-ylbutanamide
SMILESNc1ccc(NC(=O)CCCN2CCOCC2)cc1
InChIInChI=1S/C14H21N3O2/c15-12-3-5-13(6-4-12)16-14(18)2-1-7-17-8-10-19-11-9-17/h3-6H,1-2,7-11,15H2,(H,16,18)
InChIKeyNREOKWFMZDJVHE-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.32
Rot. Bonds5

About N-(4-aminophenyl)-4-morpholin-4-ylbutanamide

N-(4-aminophenyl)-4-morpholin-4-ylbutanamide (PubChem CID 16779642) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(4-aminophenyl)-4-morpholin-4-ylbutanamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-4-morpholin-4-ylbutanamide
PubChem CID16779642
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(4-aminophenyl)-4-morpholin-4-ylbutanamide
SMILESNc1ccc(NC(=O)CCCN2CCOCC2)cc1
InChIInChI=1S/C14H21N3O2/c15-12-3-5-13(6-4-12)16-14(18)2-1-7-17-8-10-19-11-9-17/h3-6H,1-2,7-11,15H2,(H,16,18)
InChIKeyNREOKWFMZDJVHE-UHFFFAOYSA-N
XLogP1.32
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-[4-(2-morpholin-4-ylethyl)phenyl]butanamide
CID 119860982
N-(4-aminophenyl)-4-(4-methoxypiperidin-1-yl)butanamide
CID 43372575
N-[4-(aminomethyl)phenyl]-3-morpholin-4-ylpropanamide
CID 16779088
N-(4-aminophenyl)-4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]butanamide
CID 30057783
N-(4-aminophenyl)-4-(2-methyl-1,4-oxazepan-4-yl)butanamide
CID 62988421
N-(4-aminophenyl)-4-(3,5-dioxomorpholin-4-yl)butanamide
CID 61312691
N-(9H-carbazol-2-yl)-4-morpholin-4-ylbutanamide
CID 91294908
3-amino-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide;dihydrochloride
CID 119840811
4-morpholin-4-yl-N-[4-[[3-[[4-(4-morpholin-4-ylbutanoylamino)phenyl]methyl]-4,8-dioxotriazolo[4,5-f]benzotriazol-7-yl]methyl]phenyl]butanamide
CID 155809794
N-(4-aminophenyl)-3-(4,4-dimethylpiperidin-1-yl)propanamide
CID 62937712
N-(4-aminophenyl)-4-(oxan-4-yloxy)butanamide
CID 61289162
4-amino-N-(4-aminophenyl)butanamide
CID 90105668

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-4-morpholin-4-ylbutanamide?
The IUPAC name of N-(4-aminophenyl)-4-morpholin-4-ylbutanamide (CID 16779642) is N-(4-aminophenyl)-4-morpholin-4-ylbutanamide.
What is the SMILES notation for N-(4-aminophenyl)-4-morpholin-4-ylbutanamide?
The canonical SMILES for N-(4-aminophenyl)-4-morpholin-4-ylbutanamide is Nc1ccc(NC(=O)CCCN2CCOCC2)cc1.
What is the InChIKey of N-(4-aminophenyl)-4-morpholin-4-ylbutanamide?
The InChIKey is NREOKWFMZDJVHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c15-12-3-5-13(6-4-12)16-14(18)2-1-7-17-8-10-19-11-9-17/h3-6H,1-2,7-11,15H2,(H,16,18).
What are the key properties of N-(4-aminophenyl)-4-morpholin-4-ylbutanamide?
N-(4-aminophenyl)-4-morpholin-4-ylbutanamide has a molecular weight of 263.34 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-4-morpholin-4-ylbutanamide is sourced from PubChem (CID 16779642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).