N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine

C16H21NO — CID 102651499

IUPACN-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine
SMILESCCNC(C1=CCCO1)C1(c2ccccc2)CC1
InChIInChI=1S/C16H21NO/c1-2-17-15(14-9-6-12-18-14)16(10-11-16)13-7-4-3-5-8-13/h3-5,7-9,15,17H,2,6,10-12H2,1H3
InChIKeyUWMVAZMQGDAZLZ-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.00
Rot. Bonds5

About N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine

N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine (PubChem CID 102651499) has the molecular formula C16H21NO and a molecular weight of 243.35 g/mol. Its IUPAC name is N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine
PubChem CID102651499
Molecular FormulaC16H21NO
Molecular Weight243.35 g/mol
Exact Mass243.16
IUPAC NameN-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine
SMILESCCNC(C1=CCCO1)C1(c2ccccc2)CC1
InChIInChI=1S/C16H21NO/c1-2-17-15(14-9-6-12-18-14)16(10-11-16)13-7-4-3-5-8-13/h3-5,7-9,15,17H,2,6,10-12H2,1H3
InChIKeyUWMVAZMQGDAZLZ-UHFFFAOYSA-N
XLogP3.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3,4-dihydro-2H-pyran-6-yl-(1-phenylcyclopentyl)methyl]ethanamine
CID 102647409
1-[2,3-dihydrofuran-5-yl(ethylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 102651868
N-[(5-methylthiophen-2-yl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 55128692
N-[2,3-dihydrofuran-5-yl-(4-ethoxyoxan-4-yl)methyl]ethanamine
CID 102652255
N-[(2,3-dichlorophenyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 63417837
N-[(2,4-dimethylphenyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 63417836
N-[(2-tert-butylphenyl)-(2,3-dihydrofuran-5-yl)methyl]ethanamine
CID 102653731
N-ethyl-1-(1-phenylcyclopentyl)propan-1-amine
CID 63079391
N-[2,3-dihydrofuran-5-yl-(2-iodo-3-methylphenyl)methyl]ethanamine
CID 114030284
N-[(5-methyl-3-pyridinyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 115374513
N-ethyl-1-(1-phenylcyclopropyl)hexan-1-amine
CID 63080234
N-[(3-bromo-2-fluorophenyl)-(1-phenylcyclopropyl)methyl]ethanamine
CID 106645549

Frequently Asked Questions

What is the IUPAC name of N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine?
The IUPAC name of N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine (CID 102651499) is N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine.
What is the SMILES notation for N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine?
The canonical SMILES for N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine is CCNC(C1=CCCO1)C1(c2ccccc2)CC1.
What is the InChIKey of N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine?
The InChIKey is UWMVAZMQGDAZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO/c1-2-17-15(14-9-6-12-18-14)16(10-11-16)13-7-4-3-5-8-13/h3-5,7-9,15,17H,2,6,10-12H2,1H3.
What are the key properties of N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine?
N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine has a molecular weight of 243.35 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3-dihydrofuran-5-yl-(1-phenylcyclopropyl)methyl]ethanamine is sourced from PubChem (CID 102651499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).