2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine

C11H19NS — CID 60819374

IUPAC2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine
SMILESCCCNC(c1ccsc1)C(C)C
InChIInChI=1S/C11H19NS/c1-4-6-12-11(9(2)3)10-5-7-13-8-10/h5,7-9,11-12H,4,6H2,1-3H3
InChIKeyFWQCSXNCBGFGGB-UHFFFAOYSA-N
MW197.35 g/mol
LogP3.44
Rot. Bonds5

About 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine

2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine (PubChem CID 60819374) has the molecular formula C11H19NS and a molecular weight of 197.35 g/mol. Its IUPAC name is 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine
PubChem CID60819374
Molecular FormulaC11H19NS
Molecular Weight197.35 g/mol
Exact Mass197.12
IUPAC Name2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine
SMILESCCCNC(c1ccsc1)C(C)C
InChIInChI=1S/C11H19NS/c1-4-6-12-11(9(2)3)10-5-7-13-8-10/h5,7-9,11-12H,4,6H2,1-3H3
InChIKeyFWQCSXNCBGFGGB-UHFFFAOYSA-N
XLogP3.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.35
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-propyl-1-thiophen-3-ylhexan-1-amine
CID 83161557
2-methyl-1-(5-methylthiophen-3-yl)-N-propylpropan-1-amine
CID 65104961
N-[cyclobutyl(thiophen-3-yl)methyl]propan-1-amine
CID 65104762
N-propyl-1-thiophen-3-yloctan-1-amine
CID 63412772
2-methyl-1-phenyl-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 104845591
N-[(5-methylthiophen-3-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 65104445
3-methyl-N-propyl-1-thiophen-3-ylbut-3-en-1-amine
CID 79179129
N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine
CID 60819375
3-methylsulfanyl-N-propyl-1-thiophen-3-ylpropan-1-amine
CID 105153946
N-[cyclooctyl(thiophen-3-yl)methyl]propan-1-amine
CID 80611349
N-(1-thiophen-3-ylethyl)decan-1-amine
CID 63491588
N-[(2-bromofuran-3-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 106857785

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine (CID 60819374) is 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine is CCCNC(c1ccsc1)C(C)C.
What is the InChIKey of 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine?
The InChIKey is FWQCSXNCBGFGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NS/c1-4-6-12-11(9(2)3)10-5-7-13-8-10/h5,7-9,11-12H,4,6H2,1-3H3.
What are the key properties of 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine?
2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine has a molecular weight of 197.35 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propyl-1-thiophen-3-ylpropan-1-amine is sourced from PubChem (CID 60819374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).