[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol

C15H32N2O2 — CID 169429799

IUPAC[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol
SMILESCN[C@@H]1CCCC[C@H]1CO.N[C@@H]1CCCC[C@H]1CO
InChIInChI=1S/C8H17NO.C7H15NO/c1-9-8-5-3-2-4-7(8)6-10;8-7-4-2-1-3-6(7)5-9/h7-10H,2-6H2,1H3;6-7,9H,1-5,8H2/t7-,8+;6-,7+/m00/s1
InChIKeySFHGQDZTVFORGN-LAYJTVFSSA-N
MW272.43 g/mol
LogP1.25
Rot. Bonds3

About [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol

[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol (PubChem CID 169429799) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol
PubChem CID169429799
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol
SMILESCN[C@@H]1CCCC[C@H]1CO.N[C@@H]1CCCC[C@H]1CO
InChIInChI=1S/C8H17NO.C7H15NO/c1-9-8-5-3-2-4-7(8)6-10;8-7-4-2-1-3-6(7)5-9/h7-10H,2-6H2,1H3;6-7,9H,1-5,8H2/t7-,8+;6-,7+/m00/s1
InChIKeySFHGQDZTVFORGN-LAYJTVFSSA-N
XLogP1.25
TPSA78.51 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol with MolForge

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Related Compounds

[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
cis-(1R,2S)-2-N-methylcyclohexane-1,2-diamine
CID 55284519
3-(ethylamino)cyclohexan-1-ol;[(1R)-2-(methylamino)cyclohexyl]methanol
CID 143885444
trans-(1R,2R)-1-N-methylcyclopentane-1,2-diamine
CID 89035848
2-hydroperoxy-2-methylpropane;2-N-methylcyclohexane-1,2-diamine
CID 144602464
2-ethyl-N-methylcycloheptan-1-amine;propan-1-ol
CID 71071435
[1-[[2-(methylamino)cyclohexyl]methyl]pyrrolidin-3-yl]methanol
CID 112629018
2-amino-N-[2-(hydroxymethyl)cyclopentyl]cyclohexane-1-carboxamide
CID 103811440
2-butyl-N-methylcyclohexan-1-amine;propan-1-ol
CID 71071796
[2-(1-cyclopentylethylamino)cyclopentyl]methanol
CID 115723803
[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
CID 106359831
(1S)-2-(methylaminomethyl)cyclohexan-1-amine
CID 129138174

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol?
The IUPAC name of [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol (CID 169429799) is [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol.
What is the SMILES notation for [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol?
The canonical SMILES for [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol is CN[C@@H]1CCCC[C@H]1CO.N[C@@H]1CCCC[C@H]1CO.
What is the InChIKey of [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol?
The InChIKey is SFHGQDZTVFORGN-LAYJTVFSSA-N. The full InChI is InChI=1S/C8H17NO.C7H15NO/c1-9-8-5-3-2-4-7(8)6-10;8-7-4-2-1-3-6(7)5-9/h7-10H,2-6H2,1H3;6-7,9H,1-5,8H2/t7-,8+;6-,7+/m00/s1.
What are the key properties of [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol?
[(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol has a molecular weight of 272.43 g/mol, XLogP of 1.25, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-aminocyclohexyl]methanol;[(1R,2R)-2-(methylamino)cyclohexyl]methanol is sourced from PubChem (CID 169429799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).