N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine

C16H27NS — CID 65001162

IUPACN-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine
SMILESCCC1(CC)CC(CNC(C)C)(c2cccs2)C1
InChIInChI=1S/C16H27NS/c1-5-15(6-2)10-16(11-15,12-17-13(3)4)14-8-7-9-18-14/h7-9,13,17H,5-6,10-12H2,1-4H3
InChIKeyKWWLPKRZYZJAQL-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.58
Rot. Bonds6

About N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine

N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine (PubChem CID 65001162) has the molecular formula C16H27NS and a molecular weight of 265.47 g/mol. Its IUPAC name is N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine
PubChem CID65001162
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC NameN-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine
SMILESCCC1(CC)CC(CNC(C)C)(c2cccs2)C1
InChIInChI=1S/C16H27NS/c1-5-15(6-2)10-16(11-15,12-17-13(3)4)14-8-7-9-18-14/h7-9,13,17H,5-6,10-12H2,1-4H3
InChIKeyKWWLPKRZYZJAQL-UHFFFAOYSA-N
XLogP4.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-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-[(3,3-dimethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine
CID 64997430
N-[(1-thiophen-2-ylcycloheptyl)methyl]propan-2-amine
CID 55095998
N-[(4-thiophen-2-yloxan-4-yl)methyl]propan-2-amine
CID 62594784
1-(3,3-dipropyl-1-thiophen-2-ylcyclobutyl)-N-methylmethanamine
CID 65005147
N-[(3,3-dimethyl-1-thiophen-2-ylcyclobutyl)methyl]ethanamine
CID 64998229
N-[(2-thiophen-2-ylspiro[3.3]heptan-2-yl)methyl]propan-1-amine
CID 65009716
2-[1-(2-methylpropyl)cyclohexyl]thiophene
CID 121406244
N-[[4-(2-thiophen-2-ylethyl)oxan-4-yl]methyl]propan-2-amine
CID 63774106
N-[(1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
CID 62595338
(2S)-N-(methylcarbamoyl)-2-[(1-thiophen-2-ylcyclopentyl)methylamino]propanamide
CID 95156564
N-[[1-(2-chloro-4-fluorophenyl)-3,3-diethylcyclobutyl]methyl]propan-2-amine
CID 65001631
N-[(2-propan-2-yl-2-thiophen-2-ylcyclopropyl)methyl]propan-2-amine
CID 62708952

Frequently Asked Questions

What is the IUPAC name of N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine?
The IUPAC name of N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine (CID 65001162) is N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine.
What is the SMILES notation for N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine?
The canonical SMILES for N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine is CCC1(CC)CC(CNC(C)C)(c2cccs2)C1.
What is the InChIKey of N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine?
The InChIKey is KWWLPKRZYZJAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-5-15(6-2)10-16(11-15,12-17-13(3)4)14-8-7-9-18-14/h7-9,13,17H,5-6,10-12H2,1-4H3.
What are the key properties of N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine?
N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine has a molecular weight of 265.47 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,3-diethyl-1-thiophen-2-ylcyclobutyl)methyl]propan-2-amine is sourced from PubChem (CID 65001162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).