cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol

C9H19NO — CID 167273942

IUPACcis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol
SMILESCCCN[C@@H]1CCC[C@@]1(C)O
InChIInChI=1S/C9H19NO/c1-3-7-10-8-5-4-6-9(8,2)11/h8,10-11H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKeyIYMDMPWWUAVSKU-RKDXNWHRSA-N
MW157.26 g/mol
LogP1.29
Rot. Bonds3

About cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol

cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol (PubChem CID 167273942) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol
PubChem CID167273942
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Namecis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol
SMILESCCCN[C@@H]1CCC[C@@]1(C)O
InChIInChI=1S/C9H19NO/c1-3-7-10-8-5-4-6-9(8,2)11/h8,10-11H,3-7H2,1-2H3/t8-,9-/m1/s1
InChIKeyIYMDMPWWUAVSKU-RKDXNWHRSA-N
XLogP1.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol?
The IUPAC name of cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol (CID 167273942) is cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol.
What is the SMILES notation for cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol?
The canonical SMILES for cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol is CCCN[C@@H]1CCC[C@@]1(C)O.
What is the InChIKey of cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol?
The InChIKey is IYMDMPWWUAVSKU-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-7-10-8-5-4-6-9(8,2)11/h8,10-11H,3-7H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol?
cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-1-methyl-2-(propylamino)cyclopentan-1-ol is sourced from PubChem (CID 167273942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).