2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine

C15H16N6S — CID 123869691

IUPAC2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine
SMILESNc1cc(-c2nc(NC3CCNC3)c3sccc3n2)ccn1
InChIInChI=1S/C15H16N6S/c16-12-7-9(1-5-18-12)14-20-11-3-6-22-13(11)15(21-14)19-10-2-4-17-8-10/h1,3,5-7,10,17H,2,4,8H2,(H2,16,18)(H,19,20,21)
InChIKeyGOVURQBWVCXDFU-UHFFFAOYSA-N
MW312.40 g/mol
LogP2.11
Rot. Bonds3

About 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine

2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 123869691) has the molecular formula C15H16N6S and a molecular weight of 312.40 g/mol. Its IUPAC name is 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine
PubChem CID123869691
Molecular FormulaC15H16N6S
Molecular Weight312.40 g/mol
Exact Mass312.12
IUPAC Name2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine
SMILESNc1cc(-c2nc(NC3CCNC3)c3sccc3n2)ccn1
InChIInChI=1S/C15H16N6S/c16-12-7-9(1-5-18-12)14-20-11-3-6-22-13(11)15(21-14)19-10-2-4-17-8-10/h1,3,5-7,10,17H,2,4,8H2,(H2,16,18)(H,19,20,21)
InChIKeyGOVURQBWVCXDFU-UHFFFAOYSA-N
XLogP2.11
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.40
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

(1R)-1-phenyl-2-[[4-[4-(pyrrolidin-3-ylamino)thieno[3,2-d]pyrimidin-2-yl]-2-pyridinyl]amino]ethanol
CID 118893266
N-cyclopentyl-2-[2-(propan-2-ylamino)-4-pyridinyl]thieno[3,2-d]pyrimidin-4-amine
CID 158342872
2-(2-benzyl-4-pyridinyl)-N-cyclopentylthieno[3,2-d]pyrimidin-4-amine
CID 140658148
2-N-(3-methyl-1,2-thiazol-5-yl)-4-N-[(3R)-pyrrolidin-3-yl]thieno[3,2-d]pyrimidine-2,4-diamine
CID 122420545
2-[2-[(4-chloro-2-pyridinyl)amino]-4-pyridinyl]-N-pyrrolidin-3-ylpyrido[3,4-d]pyrimidin-4-amine
CID 90098602
2-[4-[4-[[(3R)-1-methylpyrrolidin-3-yl]amino]thieno[3,2-d]pyrimidin-2-yl]-2-pyridinyl]-1-thiophen-2-ylethanone
CID 159541603
2-[2-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]amino]-4-pyridinyl]-N-[(3R)-pyrrolidin-3-yl]pyrido[3,4-d]pyrimidin-4-amine
CID 90099090
4-N-(1-methylpiperidin-4-yl)thieno[3,2-d]pyrimidine-2,4-diamine
CID 112750428
4-N-[(3S)-pyrrolidin-3-yl]pyrimidine-2,4-diamine
CID 59631600
N-[(3S)-pyrrolidin-3-yl]furo[3,2-c]pyridin-4-amine
CID 129414245
4-N-(4-methoxycyclohexyl)thieno[3,2-d]pyrimidine-2,4-diamine
CID 145256416
5-[[4-[(4-hydroxy-4-methylcyclohexyl)amino]thieno[3,2-d]pyrimidin-2-yl]methyl]-N-[(3R)-pyrrolidin-3-yl]-1,2-thiazole-3-carboxamide
CID 158089385

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine (CID 123869691) is 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine is Nc1cc(-c2nc(NC3CCNC3)c3sccc3n2)ccn1.
What is the InChIKey of 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is GOVURQBWVCXDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6S/c16-12-7-9(1-5-18-12)14-20-11-3-6-22-13(11)15(21-14)19-10-2-4-17-8-10/h1,3,5-7,10,17H,2,4,8H2,(H2,16,18)(H,19,20,21).
What are the key properties of 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine?
2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 312.40 g/mol, XLogP of 2.11, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-pyridinyl)-N-pyrrolidin-3-ylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 123869691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).