rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans

C9H19NO — CID 58959528

IUPACcis-(1R,2S)-2-(tert-butylamino)cyclopentan-1-ol
SMILESCC(C)(C)N[C@H]1CCC[C@H]1O
InChIInChI=1S/C9H19NO/c1-9(2,3)10-7-5-4-6-8(7)11/h7-8,10-11H,4-6H2,1-3H3/t7-,8+/m0/s1
InChIKeyQERSUMFLRHQPON-JGVFFNPUSA-N
MW157.25 g/mol
LogP1.10
Rot. Bonds2

About rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans

rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans (PubChem CID 58959528) has the molecular formula C9H19NO and a molecular weight of 157.25 g/mol. Its IUPAC name is cis-(1R,2S)-2-(tert-butylamino)cyclopentan-1-ol.

Molecular Properties

Compound Namerac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans
PubChem CID58959528
Molecular FormulaC9H19NO
Molecular Weight157.25 g/mol
Exact Mass157.15
IUPAC Namecis-(1R,2S)-2-(tert-butylamino)cyclopentan-1-ol
SMILESCC(C)(C)N[C@H]1CCC[C@H]1O
InChIInChI=1S/C9H19NO/c1-9(2,3)10-7-5-4-6-8(7)11/h7-8,10-11H,4-6H2,1-3H3/t7-,8+/m0/s1
InChIKeyQERSUMFLRHQPON-JGVFFNPUSA-N
XLogP1.10
TPSA32.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity128

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.25
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol
CID 14938219
rac-(1R,2R)-2-(methylamino)cyclopentan-1-ol
CID 15696255
rac-(1R,2R)-2-(cyclopropylamino)cyclopentan-1-ol
CID 92555045
2-(Methylamino)cyclopentan-1-ol
CID 21464889
(1S,2R)-2-(Methylamino)cyclopentan-1-ol
CID 15696256
2-{[2-(Dimethylamino)-2-methylpropyl]amino}cyclopentan-1-ol
CID 61659080
1-(Tert-butylamino)pentan-2-ol
CID 62774523
trans-(1R,2R)-2-(propan-2-ylamino)cyclopentan-1-ol
CID 338651
2-(Cyclohexylamino)cyclopentan-1-ol
CID 341192
Cyclopentanol, 2-(butylamino)-, trans-
CID 93317320
2-(3,3,3-Trifluoropropylamino)cyclopentan-1-ol
CID 63226872
trans-(1S,2S)-2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol
CID 102733445

Frequently Asked Questions

What is the IUPAC name of rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans?
The IUPAC name of rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans (CID 58959528) is cis-(1R,2S)-2-(tert-butylamino)cyclopentan-1-ol.
What is the SMILES notation for rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans?
The canonical SMILES for rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans is CC(C)(C)N[C@H]1CCC[C@H]1O.
What is the InChIKey of rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans?
The InChIKey is QERSUMFLRHQPON-JGVFFNPUSA-N. The full InChI is InChI=1S/C9H19NO/c1-9(2,3)10-7-5-4-6-8(7)11/h7-8,10-11H,4-6H2,1-3H3/t7-,8+/m0/s1.
What are the key properties of rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans?
rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans has a molecular weight of 157.25 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for rac-(1R,2R)-2-(tert-butylamino)cyclopentan-1-ol,trans is sourced from PubChem (CID 58959528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).