2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine

C13H19NO — CID 65480359

IUPAC2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine
SMILESNCCC1(COCc2ccccc2)CC1
InChIInChI=1S/C13H19NO/c14-9-8-13(6-7-13)11-15-10-12-4-2-1-3-5-12/h1-5H,6-11,14H2
InChIKeyKFVCJAPJDBPAIP-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.33
Rot. Bonds6

About 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine

2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine (PubChem CID 65480359) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine
PubChem CID65480359
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine
SMILESNCCC1(COCc2ccccc2)CC1
InChIInChI=1S/C13H19NO/c14-9-8-13(6-7-13)11-15-10-12-4-2-1-3-5-12/h1-5H,6-11,14H2
InChIKeyKFVCJAPJDBPAIP-UHFFFAOYSA-N
XLogP2.33
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4,4-dimethoxy-1-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 134289630
2-[1-(phenylmethoxymethyl)cyclopropyl]acetic acid
CID 65496133
2-[1-(thiophen-2-ylmethoxymethyl)cyclopropyl]ethanamine
CID 65495835
[1-(phenylmethoxymethyl)cyclopentyl]methanol
CID 83671115
3,3-bis(phenylmethoxymethyl)azetidine
CID 139666551
5-(bromomethyl)-5-(phenylmethoxymethyl)cycloheptene
CID 165445741
N-[[1-(phenylmethoxymethyl)cyclopropyl]methyl]propan-1-amine
CID 102940561
N-methyl-1-[1-(phenylmethoxymethyl)cyclopentyl]methanamine
CID 102940486
3-ethyl-3-(phenylmethoxymethyl)oxetane
CID 22066200
[3-(hydroxymethyl)oxetan-3-yl]methanol;[3-(phenylmethoxymethyl)oxetan-3-yl]methanol
CID 159973315
2-[1-[(2-fluorophenoxy)methyl]cyclopropyl]ethanamine
CID 65497942
2-(1-phenylmethoxycycloheptyl)ethanamine
CID 115046142

Frequently Asked Questions

What is the IUPAC name of 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine?
The IUPAC name of 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine (CID 65480359) is 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine is NCCC1(COCc2ccccc2)CC1.
What is the InChIKey of 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine?
The InChIKey is KFVCJAPJDBPAIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-9-8-13(6-7-13)11-15-10-12-4-2-1-3-5-12/h1-5H,6-11,14H2.
What are the key properties of 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine?
2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine is sourced from PubChem (CID 65480359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).