(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide

C16H32N4O2 — CID 95967596

IUPAC(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide
SMILESCCN1CCN(C[C@H](C)CNC(=O)N2CCO[C@H](C)C2)CC1
InChIInChI=1S/C16H32N4O2/c1-4-18-5-7-19(8-6-18)12-14(2)11-17-16(21)20-9-10-22-15(3)13-20/h14-15H,4-13H2,1-3H3,(H,17,21)/t14-,15-/m1/s1
InChIKeyDWMCVOVIDGSMER-HUUCEWRRSA-N
MW312.46 g/mol
LogP0.69
Rot. Bonds5

About (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide

(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide (PubChem CID 95967596) has the molecular formula C16H32N4O2 and a molecular weight of 312.46 g/mol. Its IUPAC name is (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide
PubChem CID95967596
Molecular FormulaC16H32N4O2
Molecular Weight312.46 g/mol
Exact Mass312.25
IUPAC Name(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide
SMILESCCN1CCN(C[C@H](C)CNC(=O)N2CCO[C@H](C)C2)CC1
InChIInChI=1S/C16H32N4O2/c1-4-18-5-7-19(8-6-18)12-14(2)11-17-16(21)20-9-10-22-15(3)13-20/h14-15H,4-13H2,1-3H3,(H,17,21)/t14-,15-/m1/s1
InChIKeyDWMCVOVIDGSMER-HUUCEWRRSA-N
XLogP0.69
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.46
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide with MolForge

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Related Compounds

(3R)-N-[(2S)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-3-hydroxypiperidine-1-carboxamide
CID 95967582
N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]azepane-1-carboxamide
CID 96520406
2-[[(2-methylmorpholine-4-carbonyl)amino]methyl]pentanoic acid
CID 65218037
N-[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-3-methylmorpholine-4-carboxamide
CID 71985639
(2S)-2-methyl-N-propan-2-ylmorpholine-4-carboxamide
CID 167135155
(2S)-N-[(2S)-3-(2-methoxyphenyl)sulfanyl-2-methylpropyl]-2-methylmorpholine-4-carboxamide
CID 95760588
4-[[(2-methylmorpholine-4-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79525234
(1S,6R)-N-[(2S)-2-methyl-3-pyrrolidin-1-ylpropyl]-9-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane-3-carboxamide
CID 100859845
3-[[(2-methyl-1,4-oxazepane-4-carbonyl)amino]methyl]pentanoic acid
CID 81070041
N-(2-cyclopentylethyl)-2-methylmorpholine-4-carboxamide
CID 78892468
(2R)-2-(1-ethylpyrazol-4-yl)-N-[(2S)-2-methyl-3-pyrazol-1-ylpropyl]morpholine-4-carboxamide
CID 99833787
3-(hydroxymethyl)-N-(2-methyl-3-piperidin-1-ylpropyl)piperidine-1-carboxamide
CID 110900914

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide?
The IUPAC name of (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide (CID 95967596) is (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide.
What is the SMILES notation for (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide?
The canonical SMILES for (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide is CCN1CCN(C[C@H](C)CNC(=O)N2CCO[C@H](C)C2)CC1.
What is the InChIKey of (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide?
The InChIKey is DWMCVOVIDGSMER-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H32N4O2/c1-4-18-5-7-19(8-6-18)12-14(2)11-17-16(21)20-9-10-22-15(3)13-20/h14-15H,4-13H2,1-3H3,(H,17,21)/t14-,15-/m1/s1.
What are the key properties of (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide?
(2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide has a molecular weight of 312.46 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2R)-3-(4-ethylpiperazin-1-yl)-2-methylpropyl]-2-methylmorpholine-4-carboxamide is sourced from PubChem (CID 95967596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).