N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine

C18H23NS — CID 62881756

IUPACN-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccsc1)C1(c2ccccc2)CC1
InChIInChI=1S/C18H23NS/c1-2-11-19-17(13-15-8-12-20-14-15)18(9-10-18)16-6-4-3-5-7-16/h3-8,12,14,17,19H,2,9-11,13H2,1H3
InChIKeyRRWPGYAYWUYIND-UHFFFAOYSA-N
MW285.46 g/mol
LogP4.39
Rot. Bonds7

About N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine

N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine (PubChem CID 62881756) has the molecular formula C18H23NS and a molecular weight of 285.46 g/mol. Its IUPAC name is N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine
PubChem CID62881756
Molecular FormulaC18H23NS
Molecular Weight285.46 g/mol
Exact Mass285.16
IUPAC NameN-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccsc1)C1(c2ccccc2)CC1
InChIInChI=1S/C18H23NS/c1-2-11-19-17(13-15-8-12-20-14-15)18(9-10-18)16-6-4-3-5-7-16/h3-8,12,14,17,19H,2,9-11,13H2,1H3
InChIKeyRRWPGYAYWUYIND-UHFFFAOYSA-N
XLogP4.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
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

Analyze N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-(1-phenylcyclobutyl)-2-thiophen-3-ylethanamine
CID 63078464
[1-(1-phenylcyclopentyl)-2-thiophen-3-ylethyl]hydrazine
CID 105217504
N-[1-(1-methoxycyclopentyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 104611504
N-[1-(1-methoxycyclohexyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 116763428
N-[1-(1-pyrrolidin-1-ylcyclopentyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 79059228
2-methyl-1-phenyl-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 104845591
N-[2-cyclopentyl-1-(1-phenylcyclobutyl)ethyl]propan-1-amine
CID 63417932
N-[1-(1-phenylcyclopentyl)ethyl]propan-1-amine
CID 63079548
1-[1-(2-methylpropyl)cyclopentyl]-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 115856802
4-methyl-N-propyl-1-thiophen-3-ylpent-3-en-2-amine
CID 105163342
2-methyl-1-(1-phenylcyclopropyl)-N-propylprop-2-en-1-amine
CID 79177489
N-[1-(furan-2-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 61079126

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine?
The IUPAC name of N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine (CID 62881756) is N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine.
What is the SMILES notation for N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine?
The canonical SMILES for N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine is CCCNC(Cc1ccsc1)C1(c2ccccc2)CC1.
What is the InChIKey of N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine?
The InChIKey is RRWPGYAYWUYIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NS/c1-2-11-19-17(13-15-8-12-20-14-15)18(9-10-18)16-6-4-3-5-7-16/h3-8,12,14,17,19H,2,9-11,13H2,1H3.
What are the key properties of N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine?
N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine has a molecular weight of 285.46 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-phenylcyclopropyl)-2-thiophen-3-ylethyl]propan-1-amine is sourced from PubChem (CID 62881756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).