cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine

C11H23NO2 — CID 11871353

IUPACcis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
SMILESCOC[C@@H](C)N[C@@H]1CCCC[C@@H]1OC
InChIInChI=1S/C11H23NO2/c1-9(8-13-2)12-10-6-4-5-7-11(10)14-3/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1
InChIKeyYATGIAFCGMOEFX-MXWKQRLJSA-N
MW201.31 g/mol
LogP1.57
Rot. Bonds5

About cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine

cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine (PubChem CID 11871353) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound Namecis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
PubChem CID11871353
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Namecis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
SMILESCOC[C@@H](C)N[C@@H]1CCCC[C@@H]1OC
InChIInChI=1S/C11H23NO2/c1-9(8-13-2)12-10-6-4-5-7-11(10)14-3/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1
InChIKeyYATGIAFCGMOEFX-MXWKQRLJSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 2850085
N-butan-2-yl-2-methoxycyclopentan-1-amine
CID 62089078
3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol
CID 106186803
N-hexan-2-yl-2-methoxycyclohexan-1-amine
CID 62199829
cis-(1R,2S)-2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 94347863
2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 62088372
2-(chloromethyl)-N-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 106365311
2-methoxy-N-pentan-3-ylcyclohexan-1-amine
CID 3126341
2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol
CID 60713672
1-N,1-N-diethyl-4-N-(2-methoxycyclohexyl)pentane-1,4-diamine
CID 43761171
trans-(1R,2R)-2-[[(2S)-1-methoxypropan-2-yl]amino]cyclohexane-1-carboxamide
CID 124829798
2-amino-3-methoxy-N-(2-methoxycyclohexyl)propanamide;hydrochloride
CID 120990985

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine?
The IUPAC name of cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine (CID 11871353) is cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine?
The canonical SMILES for cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine is COC[C@@H](C)N[C@@H]1CCCC[C@@H]1OC.
What is the InChIKey of cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine?
The InChIKey is YATGIAFCGMOEFX-MXWKQRLJSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(8-13-2)12-10-6-4-5-7-11(10)14-3/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1.
What are the key properties of cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine?
cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 11871353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).