[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

C14H21N5OS — CID 103332970

IUPAC[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCCCOC1CCCN(c2nc(NN)nc3sccc23)C1
InChIInChI=1S/C14H21N5OS/c1-2-7-20-10-4-3-6-19(9-10)12-11-5-8-21-13(11)17-14(16-12)18-15/h5,8,10H,2-4,6-7,9,15H2,1H3,(H,16,17,18)
InChIKeyHOWRDNLSILKUJI-UHFFFAOYSA-N
MW307.42 g/mol
LogP2.37
Rot. Bonds5

About [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine

[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (PubChem CID 103332970) has the molecular formula C14H21N5OS and a molecular weight of 307.42 g/mol. Its IUPAC name is [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
PubChem CID103332970
Molecular FormulaC14H21N5OS
Molecular Weight307.42 g/mol
Exact Mass307.15
IUPAC Name[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
SMILESCCCOC1CCCN(c2nc(NN)nc3sccc23)C1
InChIInChI=1S/C14H21N5OS/c1-2-7-20-10-4-3-6-19(9-10)12-11-5-8-21-13(11)17-14(16-12)18-15/h5,8,10H,2-4,6-7,9,15H2,1H3,(H,16,17,18)
InChIKeyHOWRDNLSILKUJI-UHFFFAOYSA-N
XLogP2.37
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.42
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103335921
[4-(4-ethyl-3-methylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103333711
[4-(3,4,5-trimethylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103335844
[4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103334986
[4-(1-oxo-1,4-thiazinan-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103332909
5-chloro-N-ethyl-4-(3-propoxypiperidin-1-yl)pyrimidin-2-amine
CID 80806982
N-methyl-4-(3-propylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103329872
[4-(2,2-dimethylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103335812
4-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103328302
N-ethyl-4-[3-(methoxymethyl)pyrrolidin-1-yl]thieno[2,3-d]pyrimidin-2-amine
CID 103328306
N-cyclopropyl-N-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335410
4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103325254

Frequently Asked Questions

What is the IUPAC name of [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine (CID 103332970) is [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is CCCOC1CCCN(c2nc(NN)nc3sccc23)C1.
What is the InChIKey of [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
The InChIKey is HOWRDNLSILKUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5OS/c1-2-7-20-10-4-3-6-19(9-10)12-11-5-8-21-13(11)17-14(16-12)18-15/h5,8,10H,2-4,6-7,9,15H2,1H3,(H,16,17,18).
What are the key properties of [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine?
[4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine has a molecular weight of 307.42 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-propoxypiperidin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103332970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).