(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine

C14H18N2OS — CID 105026593

IUPAC(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine
SMILESCCOc1cncc(C(N)c2ccc(CC)s2)c1
InChIInChI=1S/C14H18N2OS/c1-3-12-5-6-13(18-12)14(15)10-7-11(17-4-2)9-16-8-10/h5-9,14H,3-4,15H2,1-2H3
InChIKeyWYZMHHDWWBTCNG-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.15
Rot. Bonds5

About (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine

(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine (PubChem CID 105026593) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine.

Molecular Properties

Compound Name(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine
PubChem CID105026593
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine
SMILESCCOc1cncc(C(N)c2ccc(CC)s2)c1
InChIInChI=1S/C14H18N2OS/c1-3-12-5-6-13(18-12)14(15)10-7-11(17-4-2)9-16-8-10/h5-9,14H,3-4,15H2,1-2H3
InChIKeyWYZMHHDWWBTCNG-UHFFFAOYSA-N
XLogP3.15
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-bromo-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine
CID 43125136
(5-ethoxy-3-pyridinyl)-(2-ethylfuran-3-yl)methanamine
CID 114104489
(5-ethoxy-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 105175526
(2,5-dimethylphenyl)-(5-ethoxy-3-pyridinyl)methanamine
CID 105026374
(5-methoxy-3-pyridinyl)-(5-methylthiophen-2-yl)methanamine
CID 105026193
(5-ethoxy-3-pyridinyl)-(3-methoxythiophen-2-yl)methanamine
CID 105026408
[4-(difluoromethoxy)phenyl]-(5-ethylthiophen-2-yl)methanamine
CID 43322441
(5-methylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 105027557
N-[(5-ethylthiophen-2-yl)-(5-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 105027467
(3-bromo-2-methylphenyl)-(5-ethoxy-3-pyridinyl)methanamine
CID 105026543
(2-bromo-3-methylphenyl)-(5-ethoxy-3-pyridinyl)methanamine
CID 107985314
(4-bromo-3-fluorophenyl)-(5-ethoxy-3-pyridinyl)methanamine
CID 105026649

Frequently Asked Questions

What is the IUPAC name of (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine?
The IUPAC name of (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine (CID 105026593) is (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine.
What is the SMILES notation for (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine?
The canonical SMILES for (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine is CCOc1cncc(C(N)c2ccc(CC)s2)c1.
What is the InChIKey of (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine?
The InChIKey is WYZMHHDWWBTCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-3-12-5-6-13(18-12)14(15)10-7-11(17-4-2)9-16-8-10/h5-9,14H,3-4,15H2,1-2H3.
What are the key properties of (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine?
(5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine has a molecular weight of 262.38 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethoxy-3-pyridinyl)-(5-ethylthiophen-2-yl)methanamine is sourced from PubChem (CID 105026593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).