N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine

C17H21NO2 — CID 62450134

IUPACN-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCCc1cccc(OCc2ccoc2CNC2CC2)c1
InChIInChI=1S/C17H21NO2/c1-2-13-4-3-5-16(10-13)20-12-14-8-9-19-17(14)11-18-15-6-7-15/h3-5,8-10,15,18H,2,6-7,11-12H2,1H3
InChIKeyNQVUJMYXHITZQX-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.67
Rot. Bonds7

About N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine

N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine (PubChem CID 62450134) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
PubChem CID62450134
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC NameN-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCCc1cccc(OCc2ccoc2CNC2CC2)c1
InChIInChI=1S/C17H21NO2/c1-2-13-4-3-5-16(10-13)20-12-14-8-9-19-17(14)11-18-15-6-7-15/h3-5,8-10,15,18H,2,6-7,11-12H2,1H3
InChIKeyNQVUJMYXHITZQX-UHFFFAOYSA-N
XLogP3.67
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[3-[(3-chlorophenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62459727
N-[[3-[(3-methoxyphenyl)methoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62440737
N-[[3-[(2-fluoro-3-methylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 107661302
N-[[3-[(4-chloro-2,6-dimethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62449854
N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62446253
N-[[3-(hexoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62455337
N-[[3-(octoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62457612
N-[3-(3-ethylphenoxy)-2,2-dimethylpropyl]cyclopropanamine
CID 79628392
N-[[2-(3-ethylphenoxy)-3-pyridinyl]methyl]cyclopropanamine
CID 62297749
N-[[3-(3-methoxypropoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62442427
N-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]cyclopropanamine;hydrochloride
CID 6471253
N-[[3-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methyl]cyclopropanamine
CID 103046371

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine (CID 62450134) is N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine is CCc1cccc(OCc2ccoc2CNC2CC2)c1.
What is the InChIKey of N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine?
The InChIKey is NQVUJMYXHITZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-2-13-4-3-5-16(10-13)20-12-14-8-9-19-17(14)11-18-15-6-7-15/h3-5,8-10,15,18H,2,6-7,11-12H2,1H3.
What are the key properties of N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine?
N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine has a molecular weight of 271.36 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(3-ethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62450134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).