N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine

C18H23NS — CID 63078464

IUPACN-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)C1(c2ccccc2)CCC1
InChIInChI=1S/C18H23NS/c1-2-19-17(13-15-9-12-20-14-15)18(10-6-11-18)16-7-4-3-5-8-16/h3-5,7-9,12,14,17,19H,2,6,10-11,13H2,1H3
InChIKeyGYEVITGAYSQATO-UHFFFAOYSA-N
MW285.46 g/mol
LogP4.39
Rot. Bonds6

About N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine

N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine (PubChem CID 63078464) has the molecular formula C18H23NS and a molecular weight of 285.46 g/mol. Its IUPAC name is N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine
PubChem CID63078464
Molecular FormulaC18H23NS
Molecular Weight285.46 g/mol
Exact Mass285.16
IUPAC NameN-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)C1(c2ccccc2)CCC1
InChIInChI=1S/C18H23NS/c1-2-19-17(13-15-9-12-20-14-15)18(10-6-11-18)16-7-4-3-5-8-16/h3-5,7-9,12,14,17,19H,2,6,10-11,13H2,1H3
InChIKeyGYEVITGAYSQATO-UHFFFAOYSA-N
XLogP4.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.46
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 62881756
[1-(1-phenylcyclopentyl)-2-thiophen-3-ylethyl]hydrazine
CID 105217504
1-(1-ethoxycycloheptyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 116771017
N-ethyl-2-(1-methylpyrazol-4-yl)-1-(1-phenylcyclobutyl)ethanamine
CID 63080063
2-(3-bromothiophen-2-yl)-N-ethyl-1-(1-phenylcyclobutyl)ethanamine
CID 63417620
N-ethyl-1-(1-phenylcyclopentyl)propan-1-amine
CID 63079391
N-ethyl-4-methyl-1-(1-phenylcyclobutyl)pentan-1-amine
CID 63417531
N-ethyl-1-(1-phenylcyclobutyl)but-3-en-1-amine
CID 63078290
N-ethyl-1-(1-phenylcyclobutyl)pent-3-yn-1-amine
CID 63080062
N-ethyl-1-(4-methoxyoxan-4-yl)-2-thiophen-3-ylethanamine
CID 116765010
N-ethyl-2-(2-fluorophenyl)-1-(1-phenylcyclopropyl)ethanamine
CID 62879879
N-ethyl-4-methylsulfonyl-1-(1-phenylcyclobutyl)butan-1-amine
CID 63192049

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine?
The IUPAC name of N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine (CID 63078464) is N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine?
The canonical SMILES for N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine is CCNC(Cc1ccsc1)C1(c2ccccc2)CCC1.
What is the InChIKey of N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine?
The InChIKey is GYEVITGAYSQATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NS/c1-2-19-17(13-15-9-12-20-14-15)18(10-6-11-18)16-7-4-3-5-8-16/h3-5,7-9,12,14,17,19H,2,6,10-11,13H2,1H3.
What are the key properties of N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine?
N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine has a molecular weight of 285.46 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 63078464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).