1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine

C11H13N3S — CID 63352857

IUPAC1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
SMILESNC(Cc1ncnc2sccc12)C1CC1
InChIInChI=1S/C11H13N3S/c12-9(7-1-2-7)5-10-8-3-4-15-11(8)14-6-13-10/h3-4,6-7,9H,1-2,5,12H2
InChIKeyBEQFPSBWTQUPJS-UHFFFAOYSA-N
MW219.31 g/mol
LogP1.97
Rot. Bonds3

About 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine

1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine (PubChem CID 63352857) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
PubChem CID63352857
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
SMILESNC(Cc1ncnc2sccc12)C1CC1
InChIInChI=1S/C11H13N3S/c12-9(7-1-2-7)5-10-8-3-4-15-11(8)14-6-13-10/h3-4,6-7,9H,1-2,5,12H2
InChIKeyBEQFPSBWTQUPJS-UHFFFAOYSA-N
XLogP1.97
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-thieno[2,3-d]pyrimidin-4-ylpropan-2-amine
CID 63196630
1-thieno[2,3-d]pyrimidin-4-ylbutan-2-amine
CID 63197779
N-methyl-1-thieno[2,3-d]pyrimidin-4-ylpropan-2-amine
CID 63199538
4-(2-chloro-3,3-dimethylbutyl)thieno[2,3-d]pyrimidine
CID 63202692
N-methyl-1-phenyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine
CID 55162208
N-[(R)-cyclopropyl(phenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 41332400
N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 43112087
N-cyclobutylthieno[2,3-d]pyrimidin-4-amine
CID 13038304
(1-thieno[2,3-d]pyrimidin-4-ylpyrrolidin-2-yl)methanamine
CID 62591385
1-cyclopropyl-2-quinoxalin-2-ylethanamine
CID 63352950
1-cyclopropyl-2-(3-methylquinoxalin-2-yl)ethanamine
CID 55201288
2-(5-chloro-2-pyridinyl)-1-cyclopropylethanamine
CID 63352704

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The IUPAC name of 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine (CID 63352857) is 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine.
What is the SMILES notation for 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The canonical SMILES for 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine is NC(Cc1ncnc2sccc12)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
The InChIKey is BEQFPSBWTQUPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c12-9(7-1-2-7)5-10-8-3-4-15-11(8)14-6-13-10/h3-4,6-7,9H,1-2,5,12H2.
What are the key properties of 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine?
1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine has a molecular weight of 219.31 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-thieno[2,3-d]pyrimidin-4-ylethanamine is sourced from PubChem (CID 63352857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).