2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol

C9H19NO2 — CID 60713672

IUPAC2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol
SMILESCOCC(C)NC1CCCC1O
InChIInChI=1S/C9H19NO2/c1-7(6-12-2)10-8-4-3-5-9(8)11/h7-11H,3-6H2,1-2H3
InChIKeySEQRXMFSPHTWMV-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.52
Rot. Bonds4

About 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol

2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol (PubChem CID 60713672) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol
PubChem CID60713672
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol
SMILESCOCC(C)NC1CCCC1O
InChIInChI=1S/C9H19NO2/c1-7(6-12-2)10-8-4-3-5-9(8)11/h7-11H,3-6H2,1-2H3
InChIKeySEQRXMFSPHTWMV-UHFFFAOYSA-N
XLogP0.52
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol?
The IUPAC name of 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol (CID 60713672) is 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol.
What is the SMILES notation for 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol?
The canonical SMILES for 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol is COCC(C)NC1CCCC1O.
What is the InChIKey of 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol?
The InChIKey is SEQRXMFSPHTWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(6-12-2)10-8-4-3-5-9(8)11/h7-11H,3-6H2,1-2H3.
What are the key properties of 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol?
2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-ylamino)cyclopentan-1-ol is sourced from PubChem (CID 60713672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).