cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol

C6H13NO — CID 18659395

IUPACcis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol
SMILESC[C@@]1(N)CCC[C@H]1O
InChIInChI=1S/C6H13NO/c1-6(7)4-2-3-5(6)8/h5,8H,2-4,7H2,1H3/t5-,6-/m1/s1
InChIKeyILUIMBJWBNKCAR-PHDIDXHHSA-N
MW115.18 g/mol
LogP0.25
Rot. Bonds

About cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol

cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol (PubChem CID 18659395) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol
PubChem CID18659395
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Namecis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol
SMILESC[C@@]1(N)CCC[C@H]1O
InChIInChI=1S/C6H13NO/c1-6(7)4-2-3-5(6)8/h5,8H,2-4,7H2,1H3/t5-,6-/m1/s1
InChIKeyILUIMBJWBNKCAR-PHDIDXHHSA-N
XLogP0.25
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.25
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-amino-2-methylcyclopentan-1-ol?
The IUPAC name of cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol (CID 18659395) is cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol.
What is the SMILES notation for cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol?
The canonical SMILES for cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol is C[C@@]1(N)CCC[C@H]1O.
What is the InChIKey of cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol?
The InChIKey is ILUIMBJWBNKCAR-PHDIDXHHSA-N. The full InChI is InChI=1S/C6H13NO/c1-6(7)4-2-3-5(6)8/h5,8H,2-4,7H2,1H3/t5-,6-/m1/s1.
What are the key properties of cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol?
cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol has a molecular weight of 115.18 g/mol, XLogP of 0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-amino-2-methylcyclopentan-1-ol is sourced from PubChem (CID 18659395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).