2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine

C14H21NO — CID 130536828

IUPAC2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine
SMILESc1ccc(COCCNCCC2CC2)cc1
InChIInChI=1S/C14H21NO/c1-2-4-14(5-3-1)12-16-11-10-15-9-8-13-6-7-13/h1-5,13,15H,6-12H2
InChIKeyIZMZMOWBXWXMKN-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.59
Rot. Bonds8

About 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine

2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine (PubChem CID 130536828) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine
PubChem CID130536828
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine
SMILESc1ccc(COCCNCCC2CC2)cc1
InChIInChI=1S/C14H21NO/c1-2-4-14(5-3-1)12-16-11-10-15-9-8-13-6-7-13/h1-5,13,15H,6-12H2
InChIKeyIZMZMOWBXWXMKN-UHFFFAOYSA-N
XLogP2.59
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(cyclopropylmethyl)-2-phenylmethoxyethanamine
CID 62566316
3-[[4-[(2-phenylmethoxyethylamino)methyl]cyclohexyl]methylamino]propan-1-ol
CID 67960829
N-benzyl-2-(2-cyclopropylethoxy)ethanamine
CID 106206256
2-(cyclopropylmethoxy)ethoxymethylbenzene
CID 54083813
N'-(2-phenylmethoxyethyl)propane-1,3-diamine
CID 130536795
3-bromo-N-(2-phenylmethoxyethyl)propan-1-amine
CID 130537244
4-ethoxy-N-(2-phenylmethoxyethyl)butan-1-amine
CID 62564980
N-benzyl-2-(2-cyclobutylethoxy)ethanamine
CID 106206343
2-cyclopentyl-N-(2-phenylethyl)ethanamine
CID 54856926
[4-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 100982245
N-[(1-methylcyclopropyl)methyl]-2-phenylmethoxyethanamine
CID 130174466
N-(4-phenylmethoxybutyl)cyclopropanamine
CID 62445391

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine?
The IUPAC name of 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine (CID 130536828) is 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine?
The canonical SMILES for 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine is c1ccc(COCCNCCC2CC2)cc1.
What is the InChIKey of 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine?
The InChIKey is IZMZMOWBXWXMKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-4-14(5-3-1)12-16-11-10-15-9-8-13-6-7-13/h1-5,13,15H,6-12H2.
What are the key properties of 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine?
2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.59, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2-phenylmethoxyethyl)ethanamine is sourced from PubChem (CID 130536828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).