1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one

C23H28N2O3 — CID 47059658

IUPAC1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one
SMILESO=C(CCc1ccc2ccccc2c1)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C23H28N2O3/c26-22(10-8-18-7-9-19-4-1-2-5-20(19)16-18)25-11-3-6-21(17-25)23(27)24-12-14-28-15-13-24/h1-2,4-5,7,9,16,21H,3,6,8,10-15,17H2
InChIKeyLXXQZQNJPWCQTR-UHFFFAOYSA-N
MW380.49 g/mol
LogP2.87
Rot. Bonds4

About 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one

1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one (PubChem CID 47059658) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one.

Molecular Properties

Compound Name1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one
PubChem CID47059658
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one
SMILESO=C(CCc1ccc2ccccc2c1)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C23H28N2O3/c26-22(10-8-18-7-9-19-4-1-2-5-20(19)16-18)25-11-3-6-21(17-25)23(27)24-12-14-28-15-13-24/h1-2,4-5,7,9,16,21H,3,6,8,10-15,17H2
InChIKeyLXXQZQNJPWCQTR-UHFFFAOYSA-N
XLogP2.87
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one 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

3-(3-methylphenyl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 134000175
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-phenylsulfanylethanone
CID 75838690
1-(4-ethylphenyl)-4-[3-(morpholine-4-carbonyl)piperidin-1-yl]butane-1,4-dione
CID 55517872
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-2-(3-phenylpropylsulfonyl)ethanone
CID 55687640
1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoyl]piperidine-3-carboxylic acid
CID 126786883
2-(2H-indazol-3-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 47803990
4-chloro-N-[3-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-oxopropyl]benzamide
CID 18146077
1-morpholin-4-yl-3-phenylpropan-1-one
CID 532825
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 134000213
[(3R)-1-[3-(3-hydroxy-3-methylbutyl)benzoyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 95891625
(3S)-1-[3-(3,4-dichlorophenyl)propanoyl]piperidine-3-carboxamide
CID 95154870
2-[1-(3-naphthalen-2-ylpropanoyl)piperidin-4-yl]acetic acid
CID 119178286

Frequently Asked Questions

What is the IUPAC name of 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one?
The IUPAC name of 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one (CID 47059658) is 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one.
What is the SMILES notation for 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one?
The canonical SMILES for 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one is O=C(CCc1ccc2ccccc2c1)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one?
The InChIKey is LXXQZQNJPWCQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c26-22(10-8-18-7-9-19-4-1-2-5-20(19)16-18)25-11-3-6-21(17-25)23(27)24-12-14-28-15-13-24/h1-2,4-5,7,9,16,21H,3,6,8,10-15,17H2.
What are the key properties of 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one?
1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one has a molecular weight of 380.49 g/mol, XLogP of 2.87, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(morpholine-4-carbonyl)piperidin-1-yl]-3-naphthalen-2-ylpropan-1-one is sourced from PubChem (CID 47059658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).