N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine

C18H19NOS — CID 43692754

IUPACN-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine
SMILESCC(Cc1cccs1)NC(c1ccccc1)c1ccco1
InChIInChI=1S/C18H19NOS/c1-14(13-16-9-6-12-21-16)19-18(17-10-5-11-20-17)15-7-3-2-4-8-15/h2-12,14,18-19H,13H2,1H3
InChIKeySAMZGHDZBNYBQL-UHFFFAOYSA-N
MW297.42 g/mol
LogP4.65
Rot. Bonds6

About N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine

N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine (PubChem CID 43692754) has the molecular formula C18H19NOS and a molecular weight of 297.42 g/mol. Its IUPAC name is N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine
PubChem CID43692754
Molecular FormulaC18H19NOS
Molecular Weight297.42 g/mol
Exact Mass297.12
IUPAC NameN-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine
SMILESCC(Cc1cccs1)NC(c1ccccc1)c1ccco1
InChIInChI=1S/C18H19NOS/c1-14(13-16-9-6-12-21-16)19-18(17-10-5-11-20-17)15-7-3-2-4-8-15/h2-12,14,18-19H,13H2,1H3
InChIKeySAMZGHDZBNYBQL-UHFFFAOYSA-N
XLogP4.65
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]ethanamine
CID 81402613
N-propan-2-yl-1-thiophen-2-ylpropan-2-amine
CID 15162973
N-[furan-2-yl(phenyl)methyl]-1-methylsulfonylpropan-2-amine
CID 64629529
3-[[furan-2-yl(phenyl)methyl]amino]butanamide
CID 115573315
1-cyclobutyl-N-[furan-2-yl(phenyl)methyl]propan-2-amine
CID 115707858
N-[furan-2-yl(phenyl)methyl]-3-methylpentan-2-amine
CID 60780727
N-(1,2-dithiophen-2-ylethyl)-1-thiophen-2-ylpropan-2-amine
CID 43783115
N-[1-(3-methylphenyl)ethyl]-1-thiophen-2-ylpropan-2-amine
CID 43783062
2-N-[furan-2-yl(phenyl)methyl]-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 61477090
4-methylsulfinyl-N-(1-thiophen-2-ylpropan-2-yl)butan-2-amine
CID 115893295
N-(1-thiophen-2-ylpropan-2-yl)nonan-2-amine
CID 43692705
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-1-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone
CID 8756076

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine?
The IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine (CID 43692754) is N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine?
The canonical SMILES for N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine is CC(Cc1cccs1)NC(c1ccccc1)c1ccco1.
What is the InChIKey of N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine?
The InChIKey is SAMZGHDZBNYBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NOS/c1-14(13-16-9-6-12-21-16)19-18(17-10-5-11-20-17)15-7-3-2-4-8-15/h2-12,14,18-19H,13H2,1H3.
What are the key properties of N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine?
N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine has a molecular weight of 297.42 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(phenyl)methyl]-1-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 43692754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).