trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol

C12H23NO — CID 102733833

IUPACtrans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
SMILESC[C@@H](N[C@H]1CCC[C@@H]1O)C1CCCC1
InChIInChI=1S/C12H23NO/c1-9(10-5-2-3-6-10)13-11-7-4-8-12(11)14/h9-14H,2-8H2,1H3/t9-,11+,12+/m1/s1
InChIKeyMSZDBEAYDDGLQV-USWWRNFRSA-N
MW197.32 g/mol
LogP2.07
Rot. Bonds3

About trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol

trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol (PubChem CID 102733833) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
PubChem CID102733833
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Nametrans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
SMILESC[C@@H](N[C@H]1CCC[C@@H]1O)C1CCCC1
InChIInChI=1S/C12H23NO/c1-9(10-5-2-3-6-10)13-11-7-4-8-12(11)14/h9-14H,2-8H2,1H3/t9-,11+,12+/m1/s1
InChIKeyMSZDBEAYDDGLQV-USWWRNFRSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1R)-1-cycloheptylethyl]amino]cycloheptan-1-ol
CID 81392910
2-[[(1R)-1-cyclopentylethyl]amino]cycloheptan-1-ol
CID 81395053
trans-(1R,2R)-2-[[(1S)-1-cyclopropylethyl]amino]cyclohexan-1-ol
CID 124679605
trans-(1R,2R)-2-(1-cyclopropylethylamino)cyclobutan-1-ol
CID 130608509
(2R)-2-(propan-2-ylamino)cycloheptan-1-ol
CID 166814951
N-(1-cyclopentylethyl)-2-methylcyclopentan-1-amine
CID 63277954
4-[[(1R)-1-cyclopentylethyl]amino]oxolan-3-ol
CID 81394183
N-[(1S)-1-cyclohexylethyl]-2-methylcyclopentan-1-amine
CID 81387266
N-[(1S)-1-cycloheptylethyl]-2-methylcyclopentan-1-amine
CID 81391283
[2-(1-cyclopentylethylamino)cyclopentyl]methanol
CID 115723803
trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol
CID 102733069
N-(1-cyclopentylethyl)-2-methylcyclohexan-1-amine
CID 62631533

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol (CID 102733833) is trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol is C[C@@H](N[C@H]1CCC[C@@H]1O)C1CCCC1.
What is the InChIKey of trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol?
The InChIKey is MSZDBEAYDDGLQV-USWWRNFRSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(10-5-2-3-6-10)13-11-7-4-8-12(11)14/h9-14H,2-8H2,1H3/t9-,11+,12+/m1/s1.
What are the key properties of trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol?
trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol is sourced from PubChem (CID 102733833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).