N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine

C19H27NO — CID 63398712

IUPACN-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine
SMILESCCCNC(C)Cc1ccc(-c2ccc(CCC)cc2)o1
InChIInChI=1S/C19H27NO/c1-4-6-16-7-9-17(10-8-16)19-12-11-18(21-19)14-15(3)20-13-5-2/h7-12,15,20H,4-6,13-14H2,1-3H3
InChIKeyYMXIKOGQSBWGHP-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.83
Rot. Bonds8

About N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine

N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine (PubChem CID 63398712) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine.

Molecular Properties

Compound NameN-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine
PubChem CID63398712
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC NameN-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine
SMILESCCCNC(C)Cc1ccc(-c2ccc(CCC)cc2)o1
InChIInChI=1S/C19H27NO/c1-4-6-16-7-9-17(10-8-16)19-12-11-18(21-19)14-15(3)20-13-5-2/h7-12,15,20H,4-6,13-14H2,1-3H3
InChIKeyYMXIKOGQSBWGHP-UHFFFAOYSA-N
XLogP4.83
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(4-bromo-3-chlorophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 107615184
N-propyl-1-(4-propylphenyl)propan-2-amine
CID 82262360
1-[5-(3-bromophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 55188418
1-[5-(1-benzothiophen-5-yl)furan-2-yl]-N-propylpropan-2-amine
CID 65474544
1-[5-(5-methyl-3-pyridinyl)furan-2-yl]-N-propylpropan-2-amine
CID 107586256
N-[[5-(4-butylphenyl)furan-2-yl]methyl]propan-2-amine
CID 43624940
1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 63398553
N-propyl-1-[5-(2,3,5-trifluorophenyl)furan-2-yl]propan-2-amine
CID 63085650
1-[5-(2-bromo-5-chlorophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 81274606
1-[5-(4-bromo-2-fluorophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 63398595
N-ethyl-1-(5-quinoxalin-6-ylfuran-2-yl)propan-2-amine
CID 63086160
1-[5-(4-iodophenyl)furan-2-yl]-N-methylpropan-2-amine
CID 55180352

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine?
The IUPAC name of N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine (CID 63398712) is N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine.
What is the SMILES notation for N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine?
The canonical SMILES for N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine is CCCNC(C)Cc1ccc(-c2ccc(CCC)cc2)o1.
What is the InChIKey of N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine?
The InChIKey is YMXIKOGQSBWGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-4-6-16-7-9-17(10-8-16)19-12-11-18(21-19)14-15(3)20-13-5-2/h7-12,15,20H,4-6,13-14H2,1-3H3.
What are the key properties of N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine?
N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine has a molecular weight of 285.43 g/mol, XLogP of 4.83, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-[5-(4-propylphenyl)furan-2-yl]propan-2-amine is sourced from PubChem (CID 63398712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).