N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine

C15H17NO — CID 125485850

IUPACN-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine
SMILESc1ccc(C[C@@H](NC2CC2)c2ccco2)cc1
InChIInChI=1S/C15H17NO/c1-2-5-12(6-3-1)11-14(16-13-8-9-13)15-7-4-10-17-15/h1-7,10,13-14,16H,8-9,11H2/t14-/m1/s1
InChIKeyIRZHJNRYWBSPGG-CQSZACIVSA-N
MW227.31 g/mol
LogP3.32
Rot. Bonds5

About N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine

N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine (PubChem CID 125485850) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine
PubChem CID125485850
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC NameN-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine
SMILESc1ccc(C[C@@H](NC2CC2)c2ccco2)cc1
InChIInChI=1S/C15H17NO/c1-2-5-12(6-3-1)11-14(16-13-8-9-13)15-7-4-10-17-15/h1-7,10,13-14,16H,8-9,11H2/t14-/m1/s1
InChIKeyIRZHJNRYWBSPGG-CQSZACIVSA-N
XLogP3.32
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(furan-2-yl)-2-phenylethyl]propan-2-amine
CID 125485917
2-(1-chloro-2-phenylethyl)furan
CID 63016846
2-[(3,4-dimethylcyclohexyl)amino]-2-(furan-2-yl)ethanol
CID 75509295
2-N-cyclopropyl-3-phenylpropane-1,2-diamine
CID 62070151
2-(cyclopropylamino)-3-phenylpropanenitrile
CID 43151723
1-N-[1-(furan-2-yl)-2-(2-methylpropoxy)ethyl]-4-N,4-N-dimethylcyclohexane-1,4-diamine
CID 119036267
N-[1-(furan-2-yl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64731661
4-[[1-(4-methoxyphenyl)-2-phenylethyl]amino]cyclohexan-1-ol
CID 139003231
1-(furan-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 63949985
N-[(1S)-1-[(2S)-oxolan-2-yl]-2-phenylethyl]cyclopropanamine
CID 125485962
2-(cyclopropylamino)-3-phenylpropanamide
CID 60796180
[1-(furan-2-yl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105213543

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine?
The IUPAC name of N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine (CID 125485850) is N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine is c1ccc(C[C@@H](NC2CC2)c2ccco2)cc1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine?
The InChIKey is IRZHJNRYWBSPGG-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17NO/c1-2-5-12(6-3-1)11-14(16-13-8-9-13)15-7-4-10-17-15/h1-7,10,13-14,16H,8-9,11H2/t14-/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine?
N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine has a molecular weight of 227.31 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine is sourced from PubChem (CID 125485850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).