cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol

C9H19NO — CID 14687469

IUPACcis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(N)[C@H]1CCCC[C@H]1O
InChIInChI=1S/C9H19NO/c1-9(2,10)7-5-3-4-6-8(7)11/h7-8,11H,3-6,10H2,1-2H3/t7-,8+/m0/s1
InChIKeyOYZFENRUFMXWND-JGVFFNPUSA-N
MW157.26 g/mol
LogP1.27
Rot. Bonds1

About cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol

cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol (PubChem CID 14687469) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol
PubChem CID14687469
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Namecis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(N)[C@H]1CCCC[C@H]1O
InChIInChI=1S/C9H19NO/c1-9(2,10)7-5-3-4-6-8(7)11/h7-8,11H,3-6,10H2,1-2H3/t7-,8+/m0/s1
InChIKeyOYZFENRUFMXWND-JGVFFNPUSA-N
XLogP1.27
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol?
The IUPAC name of cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol (CID 14687469) is cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol?
The canonical SMILES for cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol is CC(C)(N)[C@H]1CCCC[C@H]1O.
What is the InChIKey of cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol?
The InChIKey is OYZFENRUFMXWND-JGVFFNPUSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(2,10)7-5-3-4-6-8(7)11/h7-8,11H,3-6,10H2,1-2H3/t7-,8+/m0/s1.
What are the key properties of cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol?
cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-(2-aminopropan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 14687469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).