N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine

C14H21NO — CID 66023995

IUPACN-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1(CCOc2ccccc2)CC1
InChIInChI=1S/C14H21NO/c1-2-15-12-14(8-9-14)10-11-16-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3
InChIKeyWFXYCUIBUYERPZ-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.85
Rot. Bonds7

About N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine

N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine (PubChem CID 66023995) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine
PubChem CID66023995
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1(CCOc2ccccc2)CC1
InChIInChI=1S/C14H21NO/c1-2-15-12-14(8-9-14)10-11-16-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3
InChIKeyWFXYCUIBUYERPZ-UHFFFAOYSA-N
XLogP2.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(2-phenoxyethyl)oxan-4-yl]methyl]ethanamine
CID 62904851
N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]propan-2-amine
CID 66025781
2-methyl-N-[[1-(2-phenoxyethyl)cyclopentyl]methyl]propan-2-amine
CID 62725403
N-[[3-[2-(4-bromophenoxy)ethyl]oxolan-3-yl]methyl]ethanamine
CID 62719737
N-ethyl-5-phenoxypentan-1-amine
CID 54394184
N-methyl-1-[3-(2-phenoxyethyl)oxolan-3-yl]methanamine
CID 62717701
N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
CID 106457012
N'-hydroxy-2-[1-[(2-phenoxyethylamino)methyl]cyclopropyl]ethanimidamide
CID 77070663
[1-(3-phenoxypropyl)cyclopropyl]methanamine
CID 66026187
N-methyl-1-[3-(2-phenoxyethyl)oxan-3-yl]methanamine
CID 55151607
N-[[4-(2-phenylsulfanylethyl)oxan-4-yl]methyl]ethanamine
CID 79228269
N-methyl-1-[1-(2-phenoxyethoxy)cyclopentyl]methanamine
CID 62110207

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine (CID 66023995) is N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine is CCNCC1(CCOc2ccccc2)CC1.
What is the InChIKey of N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine?
The InChIKey is WFXYCUIBUYERPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-15-12-14(8-9-14)10-11-16-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3.
What are the key properties of N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine?
N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.85, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 66023995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).