(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride

C9H20ClNO — CID 56845682

IUPAC(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride
SMILESCl.N[C@@H](CO)CC1CCCCC1
InChIInChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8;/h8-9,11H,1-7,10H2;1H/t9-;/m1./s1
InChIKeyBMHYDTXNZNVADC-SBSPUUFOSA-N
MW193.72 g/mol
LogP1.70
Rot. Bonds3

About (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride

(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride (PubChem CID 56845682) has the molecular formula C9H20ClNO and a molecular weight of 193.72 g/mol. Its IUPAC name is (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride
PubChem CID56845682
Molecular FormulaC9H20ClNO
Molecular Weight193.72 g/mol
Exact Mass193.12
IUPAC Name(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride
SMILESCl.N[C@@H](CO)CC1CCCCC1
InChIInChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8;/h8-9,11H,1-7,10H2;1H/t9-;/m1./s1
InChIKeyBMHYDTXNZNVADC-SBSPUUFOSA-N
XLogP1.70
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.72
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride?
The IUPAC name of (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride (CID 56845682) is (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride.
What is the SMILES notation for (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride?
The canonical SMILES for (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride is Cl.N[C@@H](CO)CC1CCCCC1.
What is the InChIKey of (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride?
The InChIKey is BMHYDTXNZNVADC-SBSPUUFOSA-N. The full InChI is InChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8;/h8-9,11H,1-7,10H2;1H/t9-;/m1./s1.
What are the key properties of (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride?
(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride has a molecular weight of 193.72 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride is sourced from PubChem (CID 56845682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).