3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol

C11H23NO3 — CID 106186803

IUPAC3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol
SMILESCOCC(CO)NC1CCCCC1OC
InChIInChI=1S/C11H23NO3/c1-14-8-9(7-13)12-10-5-3-4-6-11(10)15-2/h9-13H,3-8H2,1-2H3
InChIKeyLSNCHXBONMQSHC-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.54
Rot. Bonds6

About 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol

3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol (PubChem CID 106186803) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol
PubChem CID106186803
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol
SMILESCOCC(CO)NC1CCCCC1OC
InChIInChI=1S/C11H23NO3/c1-14-8-9(7-13)12-10-5-3-4-6-11(10)15-2/h9-13H,3-8H2,1-2H3
InChIKeyLSNCHXBONMQSHC-UHFFFAOYSA-N
XLogP0.54
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-pentan-3-ylcyclohexan-1-amine
CID 3126341
2-methoxy-N-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 2850085
cis-(1R,2S)-2-methoxy-N-[(2R)-1-methoxypropan-2-yl]cyclohexan-1-amine
CID 11871353
2-[(1-hydroxy-3-methoxypropan-2-yl)amino]cyclohexane-1-carbonitrile
CID 106190343
2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)-3-methoxypropan-1-ol
CID 106187583
2-amino-3-methoxy-N-(2-methoxycyclohexyl)propanamide;hydrochloride
CID 120990985
cis-(1R,2S)-2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 94347863
2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 62088372
4-methoxy-2-[[2-(trifluoromethyl)cyclohexyl]amino]butan-1-ol
CID 114210492
trans-(1R,2R)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]cyclopentan-1-ol
CID 106159498
4-methoxy-2-[(2-pyrrolidin-2-ylcyclopentyl)amino]butan-1-ol
CID 114210348
2-[[(1S,2R)-2-methylcyclohexyl]amino]propane-1,3-diol
CID 96980097

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol?
The IUPAC name of 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol (CID 106186803) is 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol.
What is the SMILES notation for 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol?
The canonical SMILES for 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol is COCC(CO)NC1CCCCC1OC.
What is the InChIKey of 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol?
The InChIKey is LSNCHXBONMQSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-14-8-9(7-13)12-10-5-3-4-6-11(10)15-2/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol?
3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol has a molecular weight of 217.31 g/mol, XLogP of 0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[(2-methoxycyclohexyl)amino]propan-1-ol is sourced from PubChem (CID 106186803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).