(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol

C10H19NO — CID 23251976

IUPAC(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol
SMILESCCN(C)C1[C@@H]2CC[C@H]1[C@H](O)C2
InChIInChI=1S/C10H19NO/c1-3-11(2)10-7-4-5-8(10)9(12)6-7/h7-10,12H,3-6H2,1-2H3/t7-,8+,9-,10?/m1/s1
InChIKeyVQAHDYOBTLLYLR-WSSOQDAQSA-N
MW169.27 g/mol
LogP1.10
Rot. Bonds2

About (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol

(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol (PubChem CID 23251976) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol.

Molecular Properties

Compound Name(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol
PubChem CID23251976
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol
SMILESCCN(C)C1[C@@H]2CC[C@H]1[C@H](O)C2
InChIInChI=1S/C10H19NO/c1-3-11(2)10-7-4-5-8(10)9(12)6-7/h7-10,12H,3-6H2,1-2H3/t7-,8+,9-,10?/m1/s1
InChIKeyVQAHDYOBTLLYLR-WSSOQDAQSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol?
The IUPAC name of (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol (CID 23251976) is (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol.
What is the SMILES notation for (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol?
The canonical SMILES for (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol is CCN(C)C1[C@@H]2CC[C@H]1[C@H](O)C2.
What is the InChIKey of (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol?
The InChIKey is VQAHDYOBTLLYLR-WSSOQDAQSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-11(2)10-7-4-5-8(10)9(12)6-7/h7-10,12H,3-6H2,1-2H3/t7-,8+,9-,10?/m1/s1.
What are the key properties of (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol?
(1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol has a molecular weight of 169.27 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,4R)-7-[ethyl(methyl)amino]bicyclo[2.2.1]heptan-2-ol is sourced from PubChem (CID 23251976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).