3-methoxy-N-phenylmethoxypropan-1-amine

C11H17NO2 — CID 64974237

IUPAC3-methoxy-N-phenylmethoxypropan-1-amine
SMILESCOCCCNOCc1ccccc1
InChIInChI=1S/C11H17NO2/c1-13-9-5-8-12-14-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKeyKGWFCLOUIQSBOY-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.74
Rot. Bonds7

About 3-methoxy-N-phenylmethoxypropan-1-amine

3-methoxy-N-phenylmethoxypropan-1-amine (PubChem CID 64974237) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 3-methoxy-N-phenylmethoxypropan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-phenylmethoxypropan-1-amine
PubChem CID64974237
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name3-methoxy-N-phenylmethoxypropan-1-amine
SMILESCOCCCNOCc1ccccc1
InChIInChI=1S/C11H17NO2/c1-13-9-5-8-12-14-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKeyKGWFCLOUIQSBOY-UHFFFAOYSA-N
XLogP1.74
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-phenylmethoxy-2-[2-[2-(phenylmethoxyamino)ethoxy]ethoxy]ethanamine
CID 10522538
4-bromo-N-phenylmethoxybutan-1-amine
CID 71377323
N-(3-methoxypropyl)-3-phenylpropan-1-amine
CID 28674385
4-(phenylmethoxyamino)butanoic acid;hydrochloride
CID 139029466
2-[2-(phenylmethoxyamino)ethoxy]ethanol
CID 64974239
2-[2-(2-methoxyethoxy)ethoxy]ethoxymethylbenzene
CID 15050635
5-methoxy-1-phenylmethoxypentan-2-one
CID 130933829
3,3,3-trifluoro-N-phenylmethoxypropan-1-amine
CID 64974455
2-methoxy-N-phenylmethoxyethanesulfonamide
CID 64973771
ethyl 6-(phenylmethoxyamino)hexanoate
CID 64974453
N'-benzyl-N-(3-methoxypropyl)ethane-1,2-diamine;carbanide;methoxymethane;uranium(2+)
CID 169243785
2-methoxy-2-methyl-N-phenylmethoxypropan-1-amine
CID 130611916

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-phenylmethoxypropan-1-amine?
The IUPAC name of 3-methoxy-N-phenylmethoxypropan-1-amine (CID 64974237) is 3-methoxy-N-phenylmethoxypropan-1-amine.
What is the SMILES notation for 3-methoxy-N-phenylmethoxypropan-1-amine?
The canonical SMILES for 3-methoxy-N-phenylmethoxypropan-1-amine is COCCCNOCc1ccccc1.
What is the InChIKey of 3-methoxy-N-phenylmethoxypropan-1-amine?
The InChIKey is KGWFCLOUIQSBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-13-9-5-8-12-14-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3.
What are the key properties of 3-methoxy-N-phenylmethoxypropan-1-amine?
3-methoxy-N-phenylmethoxypropan-1-amine has a molecular weight of 195.26 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-phenylmethoxypropan-1-amine is sourced from PubChem (CID 64974237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).