(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine

C15H21NOS — CID 114103018

IUPAC(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine
SMILESCCc1occc1C(N)c1ccc(C(C)(C)C)s1
InChIInChI=1S/C15H21NOS/c1-5-11-10(8-9-17-11)14(16)12-6-7-13(18-12)15(2,3)4/h6-9,14H,5,16H2,1-4H3
InChIKeyRPROPPUXNTVDQK-UHFFFAOYSA-N
MW263.41 g/mol
LogP4.25
Rot. Bonds3

About (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine

(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine (PubChem CID 114103018) has the molecular formula C15H21NOS and a molecular weight of 263.41 g/mol. Its IUPAC name is (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine.

Molecular Properties

Compound Name(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine
PubChem CID114103018
Molecular FormulaC15H21NOS
Molecular Weight263.41 g/mol
Exact Mass263.13
IUPAC Name(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine
SMILESCCc1occc1C(N)c1ccc(C(C)(C)C)s1
InChIInChI=1S/C15H21NOS/c1-5-11-10(8-9-17-11)14(16)12-6-7-13(18-12)15(2,3)4/h6-9,14H,5,16H2,1-4H3
InChIKeyRPROPPUXNTVDQK-UHFFFAOYSA-N
XLogP4.25
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine 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

(1S)-1-(2-ethylfuran-3-yl)propan-1-amine
CID 55291890
(3S)-3-amino-3-(2-ethylfuran-3-yl)propanenitrile
CID 55292744
(2-ethylfuran-3-yl)-(4-methoxyphenyl)methanamine
CID 114102970
2-amino-2-(2-ethylfuran-3-yl)acetic acid
CID 55295015
(2-ethylfuran-3-yl)-(2-propylpyrazol-3-yl)methanamine
CID 114104356
1-(5-tert-butylthiophen-2-yl)ethanol
CID 58902618
(5-tert-butylthiophen-2-yl)-(2-propoxyphenyl)methanol
CID 104658893
(5-ethoxy-3-pyridinyl)-(2-ethylfuran-3-yl)methanamine
CID 114104489
(2-bromo-6-fluorophenyl)-(5-tert-butylthiophen-2-yl)methanamine
CID 114559117
1-(5-tert-butylthiophen-2-yl)-2-cycloheptylethanamine
CID 114457765
1-(2-ethylfuran-3-yl)-2-(2-fluorophenyl)ethanamine
CID 114103103
(5-ethylthiophen-2-yl)-(2,4,5-trimethylphenyl)methanamine
CID 104990648

Frequently Asked Questions

What is the IUPAC name of (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine?
The IUPAC name of (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine (CID 114103018) is (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine.
What is the SMILES notation for (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine?
The canonical SMILES for (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine is CCc1occc1C(N)c1ccc(C(C)(C)C)s1.
What is the InChIKey of (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine?
The InChIKey is RPROPPUXNTVDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NOS/c1-5-11-10(8-9-17-11)14(16)12-6-7-13(18-12)15(2,3)4/h6-9,14H,5,16H2,1-4H3.
What are the key properties of (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine?
(5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine has a molecular weight of 263.41 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-tert-butylthiophen-2-yl)-(2-ethylfuran-3-yl)methanamine is sourced from PubChem (CID 114103018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).