N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine

C14H18N2OS — CID 112584876

IUPACN-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
SMILESCCC(NC)c1ccc(OCc2cccs2)cn1
InChIInChI=1S/C14H18N2OS/c1-3-13(15-2)14-7-6-11(9-16-14)17-10-12-5-4-8-18-12/h4-9,13,15H,3,10H2,1-2H3
InChIKeyBYWXKUDTKVHCSW-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.39
Rot. Bonds6

About N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine

N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine (PubChem CID 112584876) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound NameN-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
PubChem CID112584876
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC NameN-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
SMILESCCC(NC)c1ccc(OCc2cccs2)cn1
InChIInChI=1S/C14H18N2OS/c1-3-13(15-2)14-7-6-11(9-16-14)17-10-12-5-4-8-18-12/h4-9,13,15H,3,10H2,1-2H3
InChIKeyBYWXKUDTKVHCSW-UHFFFAOYSA-N
XLogP3.39
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
CID 112584875
(1R)-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
CID 103937928
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]propan-1-amine
CID 112584711
N-methyl-1-[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]propan-1-amine
CID 112584809
N-methyl-4-(thiophen-2-ylmethoxy)aniline
CID 61027856
1-[5-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]-N-methylpropan-1-amine
CID 103403032
N-[1-[5-(2-thiophen-2-ylethoxy)-2-pyridinyl]ethyl]propan-1-amine
CID 83124267
N-methyl-2-thiophen-2-yl-1-[5-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 105134087
2-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]ethanamine
CID 79800061
1-(5-cyclohexyloxy-2-pyridinyl)-N-methylpropan-1-amine
CID 112584679
N-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]ethanamine;hydrochloride
CID 17290088
N-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]propan-2-amine
CID 60880650

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine?
The IUPAC name of N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine (CID 112584876) is N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine?
The canonical SMILES for N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine is CCC(NC)c1ccc(OCc2cccs2)cn1.
What is the InChIKey of N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine?
The InChIKey is BYWXKUDTKVHCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-3-13(15-2)14-7-6-11(9-16-14)17-10-12-5-4-8-18-12/h4-9,13,15H,3,10H2,1-2H3.
What are the key properties of N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine?
N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine has a molecular weight of 262.38 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 112584876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).