2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide

C16H32N2O2 — CID 100669911

IUPAC2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CN(CCO)[C@H](C)C1CCCCC1
InChIInChI=1S/C16H32N2O2/c1-13(2)11-17-16(20)12-18(9-10-19)14(3)15-7-5-4-6-8-15/h13-15,19H,4-12H2,1-3H3,(H,17,20)/t14-/m1/s1
InChIKeyGDXIYLGSBXPMRQ-CQSZACIVSA-N
MW284.44 g/mol
LogP2.02
Rot. Bonds8

About 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide

2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide (PubChem CID 100669911) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide
PubChem CID100669911
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)CN(CCO)[C@H](C)C1CCCCC1
InChIInChI=1S/C16H32N2O2/c1-13(2)11-17-16(20)12-18(9-10-19)14(3)15-7-5-4-6-8-15/h13-15,19H,4-12H2,1-3H3,(H,17,20)/t14-/m1/s1
InChIKeyGDXIYLGSBXPMRQ-CQSZACIVSA-N
XLogP2.02
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclohexylcarbamoyl(methyl)amino]-N-(2-methylpropyl)acetamide
CID 116657767
2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylpropyl)acetamide
CID 62022001
2-[1-cyclopentylethyl-[2-(dimethylamino)ethyl]amino]acetic acid
CID 107426275
N-cyclopentyl-2-[2-hydroxyethyl(pentan-3-yl)amino]acetamide
CID 62015869
2-(cyclohexylcarbamothioylamino)-N-(2-methylpropyl)acetamide
CID 49154483
2-[1-cyclopentylethyl(2-methylpropyl)amino]acetic acid
CID 65064339
2-(dimethylamino)-N-(2-methylpropyl)acetamide
CID 20735570
2-[[(1R)-1-cyclohexylethyl]amino]-N-(2-methylpropyl)propanamide
CID 81385143
N-(2-methylpropyl)cyclooctanecarboxamide
CID 65022959
3-cyclopentyl-N-(2-methylpropyl)propanamide
CID 918369
2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride
CID 119913617
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbutanamide
CID 111425656

Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide (CID 100669911) is 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)CN(CCO)[C@H](C)C1CCCCC1.
What is the InChIKey of 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide?
The InChIKey is GDXIYLGSBXPMRQ-CQSZACIVSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-13(2)11-17-16(20)12-18(9-10-19)14(3)15-7-5-4-6-8-15/h13-15,19H,4-12H2,1-3H3,(H,17,20)/t14-/m1/s1.
What are the key properties of 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide?
2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide has a molecular weight of 284.44 g/mol, XLogP of 2.02, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-1-cyclohexylethyl]-(2-hydroxyethyl)amino]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 100669911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).