2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine

C16H17N3OS — CID 62188855

IUPAC2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(-c2cccc(OC)c2)nc2sccc12
InChIInChI=1S/C16H17N3OS/c1-3-8-17-15-13-7-9-21-16(13)19-14(18-15)11-5-4-6-12(10-11)20-2/h4-7,9-10H,3,8H2,1-2H3,(H,17,18,19)
InChIKeySIWNEPZZMSAEAS-UHFFFAOYSA-N
MW299.40 g/mol
LogP4.19
Rot. Bonds5

About 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine

2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 62188855) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
PubChem CID62188855
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC Name2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(-c2cccc(OC)c2)nc2sccc12
InChIInChI=1S/C16H17N3OS/c1-3-8-17-15-13-7-9-21-16(13)19-14(18-15)11-5-4-6-12(10-11)20-2/h4-7,9-10H,3,8H2,1-2H3,(H,17,18,19)
InChIKeySIWNEPZZMSAEAS-UHFFFAOYSA-N
XLogP4.19
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 13038355
4-chloro-2-(3-methoxyphenyl)thieno[2,3-d]pyrimidine
CID 62178883
2-(4-methylphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63485547
2-(3,5-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103399652
N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine
CID 62188842
2-chloro-N-[(3-methoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 103320788
2-(4-methyl-3-pyridinyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 114878694
2-(5-chloro-2-fluorophenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63487110
formamide;6-(3-methoxyphenyl)-N-propyl-2-pyridin-3-ylquinazolin-4-amine
CID 144500701
2-(3-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one
CID 82104586
4-N-pentyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324258
2-(3,4-dimethoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62187794

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine (CID 62188855) is 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine is CCCNc1nc(-c2cccc(OC)c2)nc2sccc12.
What is the InChIKey of 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is SIWNEPZZMSAEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-3-8-17-15-13-7-9-21-16(13)19-14(18-15)11-5-4-6-12(10-11)20-2/h4-7,9-10H,3,8H2,1-2H3,(H,17,18,19).
What are the key properties of 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine?
2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 299.40 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62188855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).