N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine

C15H14N4S — CID 47370805

IUPACN-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
SMILESc1cncc(CN(c2ncnc3ccsc23)C2CC2)c1
InChIInChI=1S/C15H14N4S/c1-2-11(8-16-6-1)9-19(12-3-4-12)15-14-13(5-7-20-14)17-10-18-15/h1-2,5-8,10,12H,3-4,9H2
InChIKeyLPWXMOAAJMEKBC-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.26
Rot. Bonds4

About N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine

N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine (PubChem CID 47370805) has the molecular formula C15H14N4S and a molecular weight of 282.37 g/mol. Its IUPAC name is N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
PubChem CID47370805
Molecular FormulaC15H14N4S
Molecular Weight282.37 g/mol
Exact Mass282.09
IUPAC NameN-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
SMILESc1cncc(CN(c2ncnc3ccsc23)C2CC2)c1
InChIInChI=1S/C15H14N4S/c1-2-11(8-16-6-1)9-19(12-3-4-12)15-14-13(5-7-20-14)17-10-18-15/h1-2,5-8,10,12H,3-4,9H2
InChIKeyLPWXMOAAJMEKBC-UHFFFAOYSA-N
XLogP3.26
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[cyclopentyl(thieno[3,2-d]pyrimidin-4-yl)amino]ethanol
CID 54999108
(1R)-2-[cyclopropyl(thieno[3,2-d]pyrimidin-4-yl)amino]-1-(4-fluorophenyl)ethanol
CID 96536411
N-propyl-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine
CID 63304405
6-[cyclopropyl(pyridin-3-ylmethyl)amino]pyridine-2-carboxylic acid
CID 122047885
N-[(3-aminophenyl)methyl]-N-cyclopropyl-3-methylpyridin-2-amine
CID 62254254
2-(aminomethyl)-N-cyclopropyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide
CID 66375904
trans-(1R,3R)-N-methyl-3-methylsulfanyl-N-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 99106803
N-[4-(aminomethyl)phenyl]-N-methylthieno[3,2-d]pyrimidin-4-amine
CID 55142521
N,4-dimethyl-N-(pyridin-3-ylmethyl)cyclohexan-1-amine;ethane;methane
CID 161242864
4-[cyclopropyl(pyridin-3-ylmethyl)amino]butan-1-ol
CID 56795318
3-cyclopentyl-1-cyclopropyl-1-(pyridin-3-ylmethyl)urea
CID 71937848
N-cyclopropyl-5-iodo-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66318811

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine (CID 47370805) is N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine is c1cncc(CN(c2ncnc3ccsc23)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is LPWXMOAAJMEKBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4S/c1-2-11(8-16-6-1)9-19(12-3-4-12)15-14-13(5-7-20-14)17-10-18-15/h1-2,5-8,10,12H,3-4,9H2.
What are the key properties of N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 282.37 g/mol, XLogP of 3.26, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 47370805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).