1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one

C21H30N2O3 — CID 110425931

IUPAC1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one
SMILESO=C(CCCCc1ccccc1)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C21H30N2O3/c24-20(9-5-4-8-18-6-2-1-3-7-18)22-12-10-19(11-13-22)21(25)23-14-16-26-17-15-23/h1-3,6-7,19H,4-5,8-17H2
InChIKeyNIUQDPRZIWPICO-UHFFFAOYSA-N
MW358.48 g/mol
LogP2.50
Rot. Bonds6

About 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one

1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one (PubChem CID 110425931) has the molecular formula C21H30N2O3 and a molecular weight of 358.48 g/mol. Its IUPAC name is 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one.

Molecular Properties

Compound Name1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one
PubChem CID110425931
Molecular FormulaC21H30N2O3
Molecular Weight358.48 g/mol
Exact Mass358.23
IUPAC Name1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one
SMILESO=C(CCCCc1ccccc1)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C21H30N2O3/c24-20(9-5-4-8-18-6-2-1-3-7-18)22-12-10-19(11-13-22)21(25)23-14-16-26-17-15-23/h1-3,6-7,19H,4-5,8-17H2
InChIKeyNIUQDPRZIWPICO-UHFFFAOYSA-N
XLogP2.50
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.48
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-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

1-[4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]piperidin-1-yl]-3-phenylpropan-1-one
CID 55845373
1-morpholin-4-yl-3-phenylpropan-1-one
CID 532825
11-phenyl-1-pyrrolidin-1-ylundecan-1-one
CID 10805309
4-[1-(3-phenylpropanoyl)piperidine-4-carbonyl]morpholine-2-carboxylic acid
CID 119239884
1-[4-[(1S)-1-morpholin-4-ylethyl]piperidin-1-yl]-4-phenylbutan-1-one
CID 95874166
4-(1,3-benzothiazol-2-yl)-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]butan-1-one
CID 38490766
4-phenylmethoxy-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]butan-1-one
CID 49374332
1-(4-benzylpiperazin-1-yl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 55446651
1-(4-methylpiperidin-1-yl)-4-phenylbutan-1-one
CID 1122148
1-[4-(cyclopent-3-ene-1-carbonyl)-1,4-diazepan-1-yl]-4-phenylbutan-1-one
CID 137336213
3-cyclohexyl-1-[4-[1-(3-phenylpropanoyl)piperidine-4-carbonyl]piperazin-1-yl]propan-1-one
CID 55916326
4-methyl-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-3-phenylpentan-1-one
CID 110620002

Frequently Asked Questions

What is the IUPAC name of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one?
The IUPAC name of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one (CID 110425931) is 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one.
What is the SMILES notation for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one?
The canonical SMILES for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one is O=C(CCCCc1ccccc1)N1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one?
The InChIKey is NIUQDPRZIWPICO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O3/c24-20(9-5-4-8-18-6-2-1-3-7-18)22-12-10-19(11-13-22)21(25)23-14-16-26-17-15-23/h1-3,6-7,19H,4-5,8-17H2.
What are the key properties of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one?
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one has a molecular weight of 358.48 g/mol, XLogP of 2.50, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-5-phenylpentan-1-one is sourced from PubChem (CID 110425931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).