N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide

C10H20N2O2 — CID 96553168

IUPACN-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide
SMILESCC(=O)N[C@@H]1CCCC[C@@H]1NCCO
InChIInChI=1S/C10H20N2O2/c1-8(14)12-10-5-3-2-4-9(10)11-6-7-13/h9-11,13H,2-7H2,1H3,(H,12,14)/t9-,10+/m0/s1
InChIKeyOVYXADDOTLEAKA-VHSXEESVSA-N
MW200.28 g/mol
LogP0.02
Rot. Bonds4

About N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide

N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide (PubChem CID 96553168) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide
PubChem CID96553168
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide
SMILESCC(=O)N[C@@H]1CCCC[C@@H]1NCCO
InChIInChI=1S/C10H20N2O2/c1-8(14)12-10-5-3-2-4-9(10)11-6-7-13/h9-11,13H,2-7H2,1H3,(H,12,14)/t9-,10+/m0/s1
InChIKeyOVYXADDOTLEAKA-VHSXEESVSA-N
XLogP0.02
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]-N-methylacetamide
CID 96554380
N-[(1S,2S)-2-[(1S,2S)-2-acetamidocyclohexyl]selanylcyclohexyl]acetamide
CID 10981236
N-[(1S,2R)-2-(2-hydroxyethylamino)cyclohexyl]-N-propan-2-ylacetamide
CID 96554405
N-[(1S,2R)-2-ethylcyclohexyl]acetamide
CID 162400753
N-[(1R,2R)-2-hydroxycyclohexyl]acetamide;hydrochloride
CID 172759321
N-[(1S,2S)-2-hydroxycycloheptyl]acetamide
CID 101001127
N-[(2R)-2-chlorocyclohexyl]acetamide
CID 18526491
2-[(2-tert-butylcyclohexyl)amino]ethanol
CID 43085233
N-[(1S,2S)-2-ethylcycloheptyl]acetamide
CID 668218
2-[[(1R,2S)-2-[cyclopropyl(methyl)amino]cyclohexyl]amino]ethanol
CID 124526902
N-(5-acetamido-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)acetamide
CID 21439703
2-[[(1S,2S)-2-[methyl(propan-2-yl)amino]cyclohexyl]amino]ethanol
CID 96554725

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide?
The IUPAC name of N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide (CID 96553168) is N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide.
What is the SMILES notation for N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide?
The canonical SMILES for N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide is CC(=O)N[C@@H]1CCCC[C@@H]1NCCO.
What is the InChIKey of N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide?
The InChIKey is OVYXADDOTLEAKA-VHSXEESVSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(14)12-10-5-3-2-4-9(10)11-6-7-13/h9-11,13H,2-7H2,1H3,(H,12,14)/t9-,10+/m0/s1.
What are the key properties of N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide?
N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide has a molecular weight of 200.28 g/mol, XLogP of 0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2S)-2-(2-hydroxyethylamino)cyclohexyl]acetamide is sourced from PubChem (CID 96553168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).