N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide

C11H22N2O2 — CID 94415851

IUPACN-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide
SMILESCCN(C)C(=O)CN[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C11H22N2O2/c1-3-13(2)11(15)8-12-9-6-4-5-7-10(9)14/h9-10,12,14H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKeyAALABCXYNFWDGU-NXEZZACHSA-N
MW214.31 g/mol
LogP0.36
Rot. Bonds4

About N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide

N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide (PubChem CID 94415851) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide
PubChem CID94415851
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide
SMILESCCN(C)C(=O)CN[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C11H22N2O2/c1-3-13(2)11(15)8-12-9-6-4-5-7-10(9)14/h9-10,12,14H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKeyAALABCXYNFWDGU-NXEZZACHSA-N
XLogP0.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,3-dimethylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 43309660
2-(cyclooctylamino)-N-ethyl-N-methylacetamide
CID 43309596
N-ethyl-2-[[(1S,2S)-2-hydroxycyclohexyl]amino]acetamide
CID 93346249
2-[(2-hydroxycyclohexyl)amino]acetic acid
CID 60886714
3-[[(1S,2S)-2-hydroxycyclohexyl]amino]-N,N-dimethylpropanamide
CID 102731154
N-butyl-2-[(2-hydroxycyclohexyl)amino]acetamide
CID 62359661
trans-(1S,2S)-2-(ethylamino)cyclohexan-1-ol
CID 28660461
cis-(1R,2S)-2-(ethylamino)cyclohexan-1-ol
CID 28660465
2-(cycloheptylmethylamino)-N-ethyl-N-methylacetamide
CID 104923486
2-[2-[ethyl(methyl)amino]ethylamino]cyclohexan-1-ol
CID 62636782
2-[(4-tert-butylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 104923581
2-[(3,4-dimethylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 64743255

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide?
The IUPAC name of N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide (CID 94415851) is N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide?
The canonical SMILES for N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide is CCN(C)C(=O)CN[C@@H]1CCCC[C@H]1O.
What is the InChIKey of N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide?
The InChIKey is AALABCXYNFWDGU-NXEZZACHSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-13(2)11(15)8-12-9-6-4-5-7-10(9)14/h9-10,12,14H,3-8H2,1-2H3/t9-,10-/m1/s1.
What are the key properties of N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide?
N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide has a molecular weight of 214.31 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide is sourced from PubChem (CID 94415851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).