(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one

C18H34N4O2 — CID 90783541

IUPAC(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one
SMILESC[C@@H](NN1CCOCC1)C(=O)N1CCC(C2CCN(C)CC2)CC1
InChIInChI=1S/C18H34N4O2/c1-15(19-22-11-13-24-14-12-22)18(23)21-9-5-17(6-10-21)16-3-7-20(2)8-4-16/h15-17,19H,3-14H2,1-2H3/t15-/m1/s1
InChIKeyGEMMKBWGJGJAOZ-OAHLLOKOSA-N
MW338.50 g/mol
LogP0.79
Rot. Bonds4

About (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one

(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one (PubChem CID 90783541) has the molecular formula C18H34N4O2 and a molecular weight of 338.50 g/mol. Its IUPAC name is (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one.

Molecular Properties

Compound Name(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one
PubChem CID90783541
Molecular FormulaC18H34N4O2
Molecular Weight338.50 g/mol
Exact Mass338.27
IUPAC Name(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one
SMILESC[C@@H](NN1CCOCC1)C(=O)N1CCC(C2CCN(C)CC2)CC1
InChIInChI=1S/C18H34N4O2/c1-15(19-22-11-13-24-14-12-22)18(23)21-9-5-17(6-10-21)16-3-7-20(2)8-4-16/h15-17,19H,3-14H2,1-2H3/t15-/m1/s1
InChIKeyGEMMKBWGJGJAOZ-OAHLLOKOSA-N
XLogP0.79
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-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

(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-3-morpholin-4-ylpropan-1-one;trihydrochloride
CID 23540155
(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-3-morpholin-4-ylpropan-1-one
CID 23540156
2-(4-tert-butylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)-N-piperidin-4-ylacetamide
CID 68177751
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
CID 69329682
(2R)-2-(2,2-dimethylhydrazinyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one
CID 90891644
(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
CID 90939985
(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(piperidin-1-ylamino)propan-1-one
CID 91087564
(2R)-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-(morpholin-4-ylamino)propan-1-one
CID 91231825
1-(2-Ethylpentyl)-4-(5-morpholin-4-yl-6-oxodiazinan-4-yl)piperazin-2-one
CID 142547081
1-[(2-Methylcyclohexyl)methyl]-4-(5-morpholin-4-yl-6-oxodiazinan-4-yl)piperazin-2-one
CID 168818618
N-[1-[2-[4-(3-morpholin-4-ylpropyl)piperidin-1-yl]acetyl]piperidin-3-yl]acetamide
CID 75451471
N-(cyclohexylmethyl)-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]propanamide
CID 78808617

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one?
The IUPAC name of (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one (CID 90783541) is (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one.
What is the SMILES notation for (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one?
The canonical SMILES for (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one is C[C@@H](NN1CCOCC1)C(=O)N1CCC(C2CCN(C)CC2)CC1.
What is the InChIKey of (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one?
The InChIKey is GEMMKBWGJGJAOZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H34N4O2/c1-15(19-22-11-13-24-14-12-22)18(23)21-9-5-17(6-10-21)16-3-7-20(2)8-4-16/h15-17,19H,3-14H2,1-2H3/t15-/m1/s1.
What are the key properties of (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one?
(2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one has a molecular weight of 338.50 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(morpholin-4-ylamino)propan-1-one is sourced from PubChem (CID 90783541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).