(2S)-1-(cyclopentyloxyamino)propan-2-ol

C8H17NO2 — CID 106932440

IUPAC(2S)-1-(cyclopentyloxyamino)propan-2-ol
SMILESC[C@H](O)CNOC1CCCC1
InChIInChI=1S/C8H17NO2/c1-7(10)6-9-11-8-4-2-3-5-8/h7-10H,2-6H2,1H3/t7-/m0/s1
InChIKeyMVSGRXXBRUACLA-ZETCQYMHSA-N
MW159.23 g/mol
LogP0.83
Rot. Bonds4

About (2S)-1-(cyclopentyloxyamino)propan-2-ol

(2S)-1-(cyclopentyloxyamino)propan-2-ol (PubChem CID 106932440) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is (2S)-1-(cyclopentyloxyamino)propan-2-ol.

Molecular Properties

Compound Name(2S)-1-(cyclopentyloxyamino)propan-2-ol
PubChem CID106932440
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name(2S)-1-(cyclopentyloxyamino)propan-2-ol
SMILESC[C@H](O)CNOC1CCCC1
InChIInChI=1S/C8H17NO2/c1-7(10)6-9-11-8-4-2-3-5-8/h7-10H,2-6H2,1H3/t7-/m0/s1
InChIKeyMVSGRXXBRUACLA-ZETCQYMHSA-N
XLogP0.83
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyloxy-2-methylpropan-1-amine
CID 83229850
1-cyclopentyloxy-3-(cyclopentyloxyamino)propan-2-ol
CID 83228878
N'-cyclopentyloxy-2-propan-2-ylpropane-1,3-diamine
CID 107442643
N-cyclopentyloxyethanamine
CID 59512196
1-(cyclooctylamino)propan-2-ol
CID 20539535
1-(cycloheptylamino)propan-2-ol
CID 43392225
N-cyclohexyloxyethanamine
CID 89167589
2-[(cyclopentyloxyamino)methyl]-3,3,3-trifluoropropanoic acid
CID 103262131
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
1-cyclododecyloxypropan-2-ol
CID 54403914
1-(cyclopentyloxyamino)-3-phenylmethoxypropan-2-ol
CID 83229084
N-cyclopentyloxy-3-methylbut-3-en-1-amine
CID 114472498

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(cyclopentyloxyamino)propan-2-ol?
The IUPAC name of (2S)-1-(cyclopentyloxyamino)propan-2-ol (CID 106932440) is (2S)-1-(cyclopentyloxyamino)propan-2-ol.
What is the SMILES notation for (2S)-1-(cyclopentyloxyamino)propan-2-ol?
The canonical SMILES for (2S)-1-(cyclopentyloxyamino)propan-2-ol is C[C@H](O)CNOC1CCCC1.
What is the InChIKey of (2S)-1-(cyclopentyloxyamino)propan-2-ol?
The InChIKey is MVSGRXXBRUACLA-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H17NO2/c1-7(10)6-9-11-8-4-2-3-5-8/h7-10H,2-6H2,1H3/t7-/m0/s1.
What are the key properties of (2S)-1-(cyclopentyloxyamino)propan-2-ol?
(2S)-1-(cyclopentyloxyamino)propan-2-ol has a molecular weight of 159.23 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(cyclopentyloxyamino)propan-2-ol is sourced from PubChem (CID 106932440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).