3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide

C16H23N3O3 — CID 119724596

IUPAC3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide
SMILESCOc1ccc(NC(=O)CC(C)N)cc1N1CCCCC1=O
InChIInChI=1S/C16H23N3O3/c1-11(17)9-15(20)18-12-6-7-14(22-2)13(10-12)19-8-4-3-5-16(19)21/h6-7,10-11H,3-5,8-9,17H2,1-2H3,(H,18,20)
InChIKeyXWKOLKIZVUGNFX-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.89
Rot. Bonds5

About 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide

3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide (PubChem CID 119724596) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide.

Molecular Properties

Compound Name3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide
PubChem CID119724596
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC Name3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide
SMILESCOc1ccc(NC(=O)CC(C)N)cc1N1CCCCC1=O
InChIInChI=1S/C16H23N3O3/c1-11(17)9-15(20)18-12-6-7-14(22-2)13(10-12)19-8-4-3-5-16(19)21/h6-7,10-11H,3-5,8-9,17H2,1-2H3,(H,18,20)
InChIKeyXWKOLKIZVUGNFX-UHFFFAOYSA-N
XLogP1.89
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-3-piperidin-4-ylbutanamide
CID 119724590
ethyl N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]carbamate
CID 7687938
3-(2,5-dioxopyrrolidin-1-yl)-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 55691831
(2S)-2-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-3,3-dimethylbutanamide;hydrochloride
CID 119724577
2-amino-3-methoxy-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]propanamide;hydrochloride
CID 120985846
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 7687070
3-[[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]carbamoyl-methylamino]-2-methylpropanoic acid
CID 122076235
N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-2-(9-oxoacridin-10-yl)acetamide
CID 55692126
N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-4-(propan-2-ylcarbamoylamino)benzamide
CID 55838376
N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-3-[(2-phenylacetyl)amino]propanamide
CID 55691949
2-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-2-methylpentanamide;hydrochloride
CID 119724605
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide
CID 55657173

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide?
The IUPAC name of 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide (CID 119724596) is 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide.
What is the SMILES notation for 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide?
The canonical SMILES for 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide is COc1ccc(NC(=O)CC(C)N)cc1N1CCCCC1=O.
What is the InChIKey of 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide?
The InChIKey is XWKOLKIZVUGNFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-11(17)9-15(20)18-12-6-7-14(22-2)13(10-12)19-8-4-3-5-16(19)21/h6-7,10-11H,3-5,8-9,17H2,1-2H3,(H,18,20).
What are the key properties of 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide?
3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide has a molecular weight of 305.38 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]butanamide is sourced from PubChem (CID 119724596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).