N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine

C14H15Cl2NO — CID 54920089

IUPACN-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine
SMILESCC(Cc1ccco1)NCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H15Cl2NO/c1-10(5-14-3-2-4-18-14)17-9-11-6-12(15)8-13(16)7-11/h2-4,6-8,10,17H,5,9H2,1H3
InChIKeyUJPMGFMXLKICEA-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.31
Rot. Bonds5

About N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine

N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine (PubChem CID 54920089) has the molecular formula C14H15Cl2NO and a molecular weight of 284.19 g/mol. Its IUPAC name is N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine
PubChem CID54920089
Molecular FormulaC14H15Cl2NO
Molecular Weight284.19 g/mol
Exact Mass283.05
IUPAC NameN-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine
SMILESCC(Cc1ccco1)NCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H15Cl2NO/c1-10(5-14-3-2-4-18-14)17-9-11-6-12(15)8-13(16)7-11/h2-4,6-8,10,17H,5,9H2,1H3
InChIKeyUJPMGFMXLKICEA-UHFFFAOYSA-N
XLogP4.31
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-bromo-5-fluorophenyl)methyl]-1-(furan-2-yl)propan-2-amine
CID 79710171
4-[[1-(furan-2-yl)propan-2-ylamino]methyl]phenol
CID 43432836
N-[(5-bromo-3-pyridinyl)methyl]-1-(furan-2-yl)propan-2-amine
CID 113454136
2-fluoro-5-[[1-(furan-2-yl)propan-2-ylamino]methyl]benzonitrile
CID 107880104
N-[(4-chloro-3-nitrophenyl)methyl]-1-(furan-2-yl)propan-2-amine
CID 115280686
1-(furan-2-yl)-N-[(4-propan-2-yloxyphenyl)methyl]propan-2-amine
CID 43783131
1-(furan-2-yl)-N-[(1-methylpyrrol-3-yl)methyl]propan-2-amine
CID 66398533
N-[(1-ethylpyrrol-3-yl)methyl]-1-(furan-2-yl)propan-2-amine
CID 66416684
N-[(5-chloro-2-nitrophenyl)methyl]-1-(furan-2-yl)propan-2-amine
CID 79582520
5-[[1-(furan-2-yl)propan-2-ylamino]methyl]-2-methoxyphenol
CID 43432891
1-(furan-2-yl)-N-(thiophen-2-ylmethyl)propan-2-amine
CID 43432946
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine?
The IUPAC name of N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine (CID 54920089) is N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine.
What is the SMILES notation for N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine?
The canonical SMILES for N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine is CC(Cc1ccco1)NCc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine?
The InChIKey is UJPMGFMXLKICEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2NO/c1-10(5-14-3-2-4-18-14)17-9-11-6-12(15)8-13(16)7-11/h2-4,6-8,10,17H,5,9H2,1H3.
What are the key properties of N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine?
N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine has a molecular weight of 284.19 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dichlorophenyl)methyl]-1-(furan-2-yl)propan-2-amine is sourced from PubChem (CID 54920089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).