1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine

C16H24N2OS — CID 62345660

IUPAC1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
SMILESCCc1ccc(C(CN)N(Cc2cccs2)C(C)C)o1
InChIInChI=1S/C16H24N2OS/c1-4-13-7-8-16(19-13)15(10-17)18(12(2)3)11-14-6-5-9-20-14/h5-9,12,15H,4,10-11,17H2,1-3H3
InChIKeyCEFVMPZAZMVGDY-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.81
Rot. Bonds7

About 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine

1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine (PubChem CID 62345660) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
PubChem CID62345660
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
SMILESCCc1ccc(C(CN)N(Cc2cccs2)C(C)C)o1
InChIInChI=1S/C16H24N2OS/c1-4-13-7-8-16(19-13)15(10-17)18(12(2)3)11-14-6-5-9-20-14/h5-9,12,15H,4,10-11,17H2,1-3H3
InChIKeyCEFVMPZAZMVGDY-UHFFFAOYSA-N
XLogP3.81
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethylphenyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 61453425
1-(2-methylphenyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 61453349
N-propan-2-yl-1-(3-propylimidazol-4-yl)-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 66130211
1-(3-chloro-2-fluorophenyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 114487837
1-(2-chloro-6-fluorophenyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 61453182
1-(2-bromo-5-chlorophenyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 66156837
N-ethyl-1-(5-ethylfuran-2-yl)-N-methylethane-1,2-diamine
CID 62346010
2-ethyl-5-(2-thiophen-2-ylethyl)furan
CID 126703067
1-N-methyl-2-N-propan-2-yl-2-N-(thiophen-2-ylmethyl)butane-1,2-diamine
CID 62462705
N-ethyl-1-(5-ethylfuran-2-yl)-N-(2-methylpropyl)ethane-1,2-diamine
CID 55061597
1-N-(3-methylbutyl)-2-N-propan-2-yl-2-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 55087518
1-N-butyl-2-N-propan-2-yl-2-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 62570543

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine (CID 62345660) is 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine is CCc1ccc(C(CN)N(Cc2cccs2)C(C)C)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine?
The InChIKey is CEFVMPZAZMVGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-4-13-7-8-16(19-13)15(10-17)18(12(2)3)11-14-6-5-9-20-14/h5-9,12,15H,4,10-11,17H2,1-3H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine?
1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine has a molecular weight of 292.45 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylfuran-2-yl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 62345660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).