N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine

C12H14ClN3OS — CID 112750187

IUPACN-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine
SMILESCN(CCOc1nc(Cl)nc2ccsc12)C1CC1
InChIInChI=1S/C12H14ClN3OS/c1-16(8-2-3-8)5-6-17-11-10-9(4-7-18-10)14-12(13)15-11/h4,7-8H,2-3,5-6H2,1H3
InChIKeyWXFZAKQFXRFDDR-UHFFFAOYSA-N
MW283.78 g/mol
LogP2.82
Rot. Bonds5

About N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine

N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine (PubChem CID 112750187) has the molecular formula C12H14ClN3OS and a molecular weight of 283.78 g/mol. Its IUPAC name is N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine.

Molecular Properties

Compound NameN-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine
PubChem CID112750187
Molecular FormulaC12H14ClN3OS
Molecular Weight283.78 g/mol
Exact Mass283.05
IUPAC NameN-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine
SMILESCN(CCOc1nc(Cl)nc2ccsc12)C1CC1
InChIInChI=1S/C12H14ClN3OS/c1-16(8-2-3-8)5-6-17-11-10-9(4-7-18-10)14-12(13)15-11/h4,7-8H,2-3,5-6H2,1H3
InChIKeyWXFZAKQFXRFDDR-UHFFFAOYSA-N
XLogP2.82
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.78
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine 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

2-chloro-4-(2-methylcyclohexyl)oxythieno[3,2-d]pyrimidine
CID 112750171
4-chloro-6-[2-[cyclopropyl(methyl)amino]ethoxy]-1,3,5-triazin-2-amine
CID 102741266
2-chloro-N-ethyl-N-methylthieno[3,2-d]pyrimidin-4-amine
CID 130535565
N-[2-(3,6-dichloropyridazin-4-yl)oxyethyl]-N-methylcyclopropanamine
CID 102740004
4-chloro-6-[2-[cyclopropyl(methyl)amino]ethoxy]-N,N-diethyl-1,3,5-triazin-2-amine
CID 102739995
4-[2-[cyclopropyl(methyl)amino]ethoxy]-5-methylpyrimidin-2-amine
CID 102741286
N-[2-[[3-chloro-5-(methylaminomethyl)-2-pyridinyl]oxy]ethyl]-N-methylcyclopropanamine
CID 102740579
6-[2-[cyclopropyl(methyl)amino]ethoxy]pyridine-2,3-diamine
CID 102739784
3-[2-[cyclopropyl(methyl)amino]ethoxy]pyrazine-2-carbonitrile
CID 102740080
6-[2-[cyclopropyl(methyl)amino]ethoxy]pyrimidine-2,4-diamine
CID 102741225
1-[(2-chloro-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl)methyl]-N-(2-methoxyethyl)-N-methylpiperidin-4-amine
CID 57493974
4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrazolo[5,4-d]pyrimidin-6-amine
CID 102741163

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine?
The IUPAC name of N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine (CID 112750187) is N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine.
What is the SMILES notation for N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine?
The canonical SMILES for N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine is CN(CCOc1nc(Cl)nc2ccsc12)C1CC1.
What is the InChIKey of N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine?
The InChIKey is WXFZAKQFXRFDDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3OS/c1-16(8-2-3-8)5-6-17-11-10-9(4-7-18-10)14-12(13)15-11/h4,7-8H,2-3,5-6H2,1H3.
What are the key properties of N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine?
N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine has a molecular weight of 283.78 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorothieno[3,2-d]pyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine is sourced from PubChem (CID 112750187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).