(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one

C18H34N4O2 — CID 90939985

IUPAC(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
SMILESCN1CCC(C2CCN(C(=O)[C@](C)(N)N3CCOCC3)CC2)CC1
InChIInChI=1S/C18H34N4O2/c1-18(19,22-11-13-24-14-12-22)17(23)21-9-5-16(6-10-21)15-3-7-20(2)8-4-15/h15-16H,3-14,19H2,1-2H3/t18-/m1/s1
InChIKeyCFAWOVWESRRPEF-GOSISDBHSA-N
MW338.50 g/mol
LogP0.57
Rot. Bonds3

About (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one

(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one (PubChem CID 90939985) has the molecular formula C18H34N4O2 and a molecular weight of 338.50 g/mol. Its IUPAC name is (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
PubChem CID90939985
Molecular FormulaC18H34N4O2
Molecular Weight338.50 g/mol
Exact Mass338.27
IUPAC Name(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
SMILESCN1CCC(C2CCN(C(=O)[C@](C)(N)N3CCOCC3)CC2)CC1
InChIInChI=1S/C18H34N4O2/c1-18(19,22-11-13-24-14-12-22)17(23)21-9-5-16(6-10-21)15-3-7-20(2)8-4-15/h15-16H,3-14,19H2,1-2H3/t18-/m1/s1
InChIKeyCFAWOVWESRRPEF-GOSISDBHSA-N
XLogP0.57
TPSA62.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one with MolForge

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Related Compounds

3-(2-Methylpropyl)-9-(morpholine-4-carbonyl)-1-propyl-1,4,9-triazaspiro[5.5]undecane-2,5-dione
CID 21926956
(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
2-(4-ethylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)-N-piperidin-4-ylacetamide
CID 68185905
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-morpholin-4-ylpropan-1-one
CID 69329124
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one;trihydrochloride
CID 69329681
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one
CID 69329682
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-piperidin-1-ylpropan-1-one;hydrochloride
CID 69329689
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-piperidin-1-ylpropan-1-one
CID 69329690
tert-butyl N-[(2S)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-yl-1-oxopropan-2-yl]carbamate
CID 69330353
(2S)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-morpholin-4-ylpropan-1-one;hydrochloride
CID 69330719

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one?
The IUPAC name of (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one (CID 90939985) is (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one.
What is the SMILES notation for (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one?
The canonical SMILES for (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one is CN1CCC(C2CCN(C(=O)[C@](C)(N)N3CCOCC3)CC2)CC1.
What is the InChIKey of (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one?
The InChIKey is CFAWOVWESRRPEF-GOSISDBHSA-N. The full InChI is InChI=1S/C18H34N4O2/c1-18(19,22-11-13-24-14-12-22)17(23)21-9-5-16(6-10-21)15-3-7-20(2)8-4-15/h15-16H,3-14,19H2,1-2H3/t18-/m1/s1.
What are the key properties of (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one?
(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one has a molecular weight of 338.50 g/mol, XLogP of 0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 90939985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).