trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol

C8H17NO — CID 12724421

IUPACtrans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol
SMILESCN(C)C[C@H]1CCC[C@H]1O
InChIInChI=1S/C8H17NO/c1-9(2)6-7-4-3-5-8(7)10/h7-8,10H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKeyVORGTYWLJRTHQX-HTQZYQBOSA-N
MW143.23 g/mol
LogP0.71
Rot. Bonds2

About trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol

trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol (PubChem CID 12724421) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol
PubChem CID12724421
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Nametrans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol
SMILESCN(C)C[C@H]1CCC[C@H]1O
InChIInChI=1S/C8H17NO/c1-9(2)6-7-4-3-5-8(7)10/h7-8,10H,3-6H2,1-2H3/t7-,8-/m1/s1
InChIKeyVORGTYWLJRTHQX-HTQZYQBOSA-N
XLogP0.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol (CID 12724421) is trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol is CN(C)C[C@H]1CCC[C@H]1O.
What is the InChIKey of trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol?
The InChIKey is VORGTYWLJRTHQX-HTQZYQBOSA-N. The full InChI is InChI=1S/C8H17NO/c1-9(2)6-7-4-3-5-8(7)10/h7-8,10H,3-6H2,1-2H3/t7-,8-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol?
trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[(dimethylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 12724421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).