2-(methoxyamino)-1-phenylpropan-1-ol

C10H15NO2 — CID 170043832

IUPAC2-(methoxyamino)-1-phenylpropan-1-ol
SMILESCONC(C)C(O)c1ccccc1
InChIInChI=1S/C10H15NO2/c1-8(11-13-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3
InChIKeyDKTILADCNFFFTQ-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.26
Rot. Bonds4

About 2-(methoxyamino)-1-phenylpropan-1-ol

2-(methoxyamino)-1-phenylpropan-1-ol (PubChem CID 170043832) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-(methoxyamino)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(methoxyamino)-1-phenylpropan-1-ol
PubChem CID170043832
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-(methoxyamino)-1-phenylpropan-1-ol
SMILESCONC(C)C(O)c1ccccc1
InChIInChI=1S/C10H15NO2/c1-8(11-13-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3
InChIKeyDKTILADCNFFFTQ-UHFFFAOYSA-N
XLogP1.26
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.26
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

(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;(1S,2R)-2-(methylamino)-1-phenylpropan-1-ol
CID 68629848
(1R)-2-(4-methoxyanilino)-1-phenylpropan-1-ol
CID 102174473
(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;sulfane
CID 162055565
(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;2-(methylamino)-1-phenylpropan-1-ol;hydrate
CID 67711321
(2S)-1-phenyl-2-(propan-2-ylamino)propan-1-ol
CID 70464274
copper;(1R,2R)-2-(methylamino)-1-phenylpropan-1-ol
CID 90401537
(1R,2S)-2-(aminomethylamino)-1-phenylpropan-1-ol
CID 142004415
(1S,2R)-2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-1-phenylpropan-1-ol
CID 118706367
(1S,2S)-2-[(4-methoxyphenyl)methylamino]-1-phenylpropan-1-ol
CID 10912623
(1S,2S)-1-phenyl-2-(trideuterio(113C)methylamino)propan-1-ol
CID 76973466
(2S)-2-chloro-1-phenylpropan-1-ol
CID 146730708
[(1-hydroxy-1-phenylpropan-2-yl)amino] 4-methylbenzenesulfonate
CID 91116728

Frequently Asked Questions

What is the IUPAC name of 2-(methoxyamino)-1-phenylpropan-1-ol?
The IUPAC name of 2-(methoxyamino)-1-phenylpropan-1-ol (CID 170043832) is 2-(methoxyamino)-1-phenylpropan-1-ol.
What is the SMILES notation for 2-(methoxyamino)-1-phenylpropan-1-ol?
The canonical SMILES for 2-(methoxyamino)-1-phenylpropan-1-ol is CONC(C)C(O)c1ccccc1.
What is the InChIKey of 2-(methoxyamino)-1-phenylpropan-1-ol?
The InChIKey is DKTILADCNFFFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-8(11-13-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3.
What are the key properties of 2-(methoxyamino)-1-phenylpropan-1-ol?
2-(methoxyamino)-1-phenylpropan-1-ol has a molecular weight of 181.23 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxyamino)-1-phenylpropan-1-ol is sourced from PubChem (CID 170043832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).