N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine

C14H25NS — CID 105177028

IUPACN-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine
SMILESCCNC(CCCC(C)C)Cc1ccsc1
InChIInChI=1S/C14H25NS/c1-4-15-14(7-5-6-12(2)3)10-13-8-9-16-11-13/h8-9,11-12,14-15H,4-7,10H2,1-3H3
InChIKeyFWKPREVTCQTRNC-UHFFFAOYSA-N
MW239.43 g/mol
LogP4.09
Rot. Bonds8

About N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine

N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine (PubChem CID 105177028) has the molecular formula C14H25NS and a molecular weight of 239.43 g/mol. Its IUPAC name is N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine
PubChem CID105177028
Molecular FormulaC14H25NS
Molecular Weight239.43 g/mol
Exact Mass239.17
IUPAC NameN-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine
SMILESCCNC(CCCC(C)C)Cc1ccsc1
InChIInChI=1S/C14H25NS/c1-4-15-14(7-5-6-12(2)3)10-13-8-9-16-11-13/h8-9,11-12,14-15H,4-7,10H2,1-3H3
InChIKeyFWKPREVTCQTRNC-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.43
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-methoxy-3-thiophen-3-ylpropan-2-amine
CID 62604477
1-(3,4-dimethylphenyl)-N-ethyl-6-methylheptan-2-amine
CID 83160928
N-ethyl-1-(3-fluorophenyl)-6-methylheptan-2-amine
CID 83161562
1-(3-chlorophenyl)-N-ethyl-3-thiophen-3-ylpropan-2-amine
CID 55095489
N-ethyl-1-phenylsulfanyl-3-thiophen-3-ylpropan-2-amine
CID 65143801
N-ethyl-1-(3-fluorophenyl)-3-thiophen-3-ylpropan-2-amine
CID 62602151
N-ethyl-1-(1-methylpyrazol-4-yl)-3-thiophen-3-ylpropan-2-amine
CID 105113824
N-ethyl-1-[4-(thiophen-3-ylmethoxy)phenyl]propan-2-amine
CID 115494944
1-thiophen-3-ylbutan-2-ylhydrazine
CID 105201099
1-(2-bromophenyl)sulfanyl-N-ethyl-3-thiophen-3-ylpropan-2-amine
CID 66143893
N-ethyl-1-(2-methyltetrazol-5-yl)-3-thiophen-3-ylpropan-2-amine
CID 107065100
N-methyl-1-propan-2-ylsulfanyl-3-thiophen-3-ylpropan-2-amine
CID 65132227

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine?
The IUPAC name of N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine (CID 105177028) is N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine.
What is the SMILES notation for N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine?
The canonical SMILES for N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine is CCNC(CCCC(C)C)Cc1ccsc1.
What is the InChIKey of N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine?
The InChIKey is FWKPREVTCQTRNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NS/c1-4-15-14(7-5-6-12(2)3)10-13-8-9-16-11-13/h8-9,11-12,14-15H,4-7,10H2,1-3H3.
What are the key properties of N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine?
N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine has a molecular weight of 239.43 g/mol, XLogP of 4.09, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-1-thiophen-3-ylheptan-2-amine is sourced from PubChem (CID 105177028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).