N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

C14H16N4S — CID 83190014

IUPACN-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCCCNc1nc(-c2ccccn2)nc2c1CSC2
InChIInChI=1S/C14H16N4S/c1-2-6-16-13-10-8-19-9-12(10)17-14(18-13)11-5-3-4-7-15-11/h3-5,7H,2,6,8-9H2,1H3,(H,16,17,18)
InChIKeyWCUFAPFVHNDHHI-UHFFFAOYSA-N
MW272.38 g/mol
LogP3.11
Rot. Bonds4

About N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (PubChem CID 83190014) has the molecular formula C14H16N4S and a molecular weight of 272.38 g/mol. Its IUPAC name is N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
PubChem CID83190014
Molecular FormulaC14H16N4S
Molecular Weight272.38 g/mol
Exact Mass272.11
IUPAC NameN-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCCCNc1nc(-c2ccccn2)nc2c1CSC2
InChIInChI=1S/C14H16N4S/c1-2-6-16-13-10-8-19-9-12(10)17-14(18-13)11-5-3-4-7-15-11/h3-5,7H,2,6,8-9H2,1H3,(H,16,17,18)
InChIKeyWCUFAPFVHNDHHI-UHFFFAOYSA-N
XLogP3.11
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (CID 83190014) is N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is CCCNc1nc(-c2ccccn2)nc2c1CSC2.
What is the InChIKey of N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The InChIKey is WCUFAPFVHNDHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4S/c1-2-6-16-13-10-8-19-9-12(10)17-14(18-13)11-5-3-4-7-15-11/h3-5,7H,2,6,8-9H2,1H3,(H,16,17,18).
What are the key properties of N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine has a molecular weight of 272.38 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-pyridin-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83190014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).