1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine

C19H27NO — CID 63398585

IUPAC1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccc(-c2ccc(C(C)C)cc2)o1
InChIInChI=1S/C19H27NO/c1-5-13-20-17(6-2)19-12-11-18(21-19)16-9-7-15(8-10-16)14(3)4/h7-12,14,17,20H,5-6,13H2,1-4H3
InChIKeyYTDHEFQGIBHZFL-UHFFFAOYSA-N
MW285.43 g/mol
LogP5.52
Rot. Bonds7

About 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine

1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine (PubChem CID 63398585) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine.

Molecular Properties

Compound Name1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine
PubChem CID63398585
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC Name1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccc(-c2ccc(C(C)C)cc2)o1
InChIInChI=1S/C19H27NO/c1-5-13-20-17(6-2)19-12-11-18(21-19)16-9-7-15(8-10-16)14(3)4/h7-12,14,17,20H,5-6,13H2,1-4H3
InChIKeyYTDHEFQGIBHZFL-UHFFFAOYSA-N
XLogP5.52
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.43
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine 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-[1-(5-methylfuran-2-yl)-2-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 115844288
1-[5-(3-fluorophenyl)furan-2-yl]-N-propylpropan-1-amine
CID 62632746
1-[5-(2-fluorophenyl)furan-2-yl]-N-propylpropan-1-amine
CID 62633103
1-[2,4-di(propan-2-yl)phenyl]-N-propylpropan-1-amine
CID 43496442
1-[5-(2-bromo-3-chlorophenyl)furan-2-yl]-N-propylpropan-1-amine
CID 103481081
3-methyl-1-(4-propan-2-ylphenyl)-N-propylpentan-1-amine
CID 63412385
3,3,3-trifluoro-1-(4-propan-2-ylphenyl)-N-propylpropan-1-amine
CID 43625498
N-[1-[5-[4-(trifluoromethyl)phenyl]furan-2-yl]ethyl]propan-1-amine
CID 63398755
1-[5-(3-chloro-4-methylphenyl)furan-2-yl]-N-methylpropan-1-amine
CID 62632916
1-[4-(4-bromophenyl)phenyl]-N-propylpropan-1-amine
CID 63888912
1-[4-(3,5-dichlorophenyl)phenyl]-N-propylpropan-1-amine
CID 114879199
1-[5-(5-bromo-4-fluoro-2-methylphenyl)furan-2-yl]-N-propylpropan-1-amine
CID 107593416

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine?
The IUPAC name of 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine (CID 63398585) is 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine.
What is the SMILES notation for 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine?
The canonical SMILES for 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine is CCCNC(CC)c1ccc(-c2ccc(C(C)C)cc2)o1.
What is the InChIKey of 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine?
The InChIKey is YTDHEFQGIBHZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-5-13-20-17(6-2)19-12-11-18(21-19)16-9-7-15(8-10-16)14(3)4/h7-12,14,17,20H,5-6,13H2,1-4H3.
What are the key properties of 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine?
1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine has a molecular weight of 285.43 g/mol, XLogP of 5.52, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-propan-2-ylphenyl)furan-2-yl]-N-propylpropan-1-amine is sourced from PubChem (CID 63398585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).