trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine

C9H17NO — CID 28798081

IUPACtrans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine
SMILESN[C@H]1CCC[C@@H]1OCC1CC1
InChIInChI=1S/C9H17NO/c10-8-2-1-3-9(8)11-6-7-4-5-7/h7-9H,1-6,10H2/t8-,9-/m0/s1
InChIKeyIBVGJOMGNZTTAS-IUCAKERBSA-N
MW155.24 g/mol
LogP1.29
Rot. Bonds3

About trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine

trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine (PubChem CID 28798081) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine
PubChem CID28798081
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Nametrans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine
SMILESN[C@H]1CCC[C@@H]1OCC1CC1
InChIInChI=1S/C9H17NO/c10-8-2-1-3-9(8)11-6-7-4-5-7/h7-9H,1-6,10H2/t8-,9-/m0/s1
InChIKeyIBVGJOMGNZTTAS-IUCAKERBSA-N
XLogP1.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine?
The IUPAC name of trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine (CID 28798081) is trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine.
What is the SMILES notation for trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine?
The canonical SMILES for trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine is N[C@H]1CCC[C@@H]1OCC1CC1.
What is the InChIKey of trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine?
The InChIKey is IBVGJOMGNZTTAS-IUCAKERBSA-N. The full InChI is InChI=1S/C9H17NO/c10-8-2-1-3-9(8)11-6-7-4-5-7/h7-9H,1-6,10H2/t8-,9-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine?
trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(cyclopropylmethoxy)cyclopentan-1-amine is sourced from PubChem (CID 28798081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).