trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol

C10H21NO — CID 102733069

IUPACtrans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol
SMILESCC(C)C(C)N[C@H]1CCC[C@@H]1O
InChIInChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-4-6-10(9)12/h7-12H,4-6H2,1-3H3/t8?,9-,10-/m0/s1
InChIKeyVGZSRTRCQTWYGW-AGROOBSYSA-N
MW171.28 g/mol
LogP1.53
Rot. Bonds3

About trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol

trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol (PubChem CID 102733069) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol
PubChem CID102733069
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nametrans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol
SMILESCC(C)C(C)N[C@H]1CCC[C@@H]1O
InChIInChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-4-6-10(9)12/h7-12H,4-6H2,1-3H3/t8?,9-,10-/m0/s1
InChIKeyVGZSRTRCQTWYGW-AGROOBSYSA-N
XLogP1.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-[[(2S)-3-methylbutan-2-yl]amino]cyclopentan-1-ol
CID 167275295
trans-(1R,2R)-2-(3-methylbutan-2-ylamino)cycloheptan-1-ol
CID 130690757
trans-(1R,2R)-2-(3-ethylpentan-2-ylamino)cyclopentan-1-ol
CID 102733490
2-(1,1-difluoropropan-2-ylamino)cycloheptan-1-ol
CID 102869994
(2R)-2-(propan-2-ylamino)cycloheptan-1-ol
CID 166814951
cis-(1R,2S)-2-[[(2S,3S)-3-methylpentan-2-yl]amino]cyclohexan-1-ol
CID 124709342
2-(3,3-dimethylbutan-2-ylamino)cyclohexan-1-ol
CID 104828064
trans-(1S,2S)-2-[[(1R)-1-cyclopentylethyl]amino]cyclopentan-1-ol
CID 102733833
trans-(1S,2S)-2-[(1-hydroxy-4-methylpentan-3-yl)amino]cyclopentan-1-ol
CID 106349423
trans-(1R,2R)-2-[[(1S)-1-cyclopropylethyl]amino]cyclohexan-1-ol
CID 124679605
trans-(1R,2R)-2-(4-hydroxypentan-2-ylamino)cyclopentan-1-ol
CID 102733975
trans-(1S,2S)-2-(propan-2-ylamino)cyclobutan-1-ol
CID 176810875

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol (CID 102733069) is trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol is CC(C)C(C)N[C@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol?
The InChIKey is VGZSRTRCQTWYGW-AGROOBSYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-4-6-10(9)12/h7-12H,4-6H2,1-3H3/t8?,9-,10-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol?
trans-(1S,2S)-2-(3-methylbutan-2-ylamino)cyclopentan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.53, 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-(3-methylbutan-2-ylamino)cyclopentan-1-ol is sourced from PubChem (CID 102733069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).