4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine

C17H17N3S — CID 24508226

IUPAC4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine
SMILESCCC1c2ccsc2CCN1c1ncnc2ccccc12
InChIInChI=1S/C17H17N3S/c1-2-15-13-8-10-21-16(13)7-9-20(15)17-12-5-3-4-6-14(12)18-11-19-17/h3-6,8,10-11,15H,2,7,9H2,1H3
InChIKeyOWZCUNHMHRFBBL-UHFFFAOYSA-N
MW295.41 g/mol
LogP4.21
Rot. Bonds2

About 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine

4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine (PubChem CID 24508226) has the molecular formula C17H17N3S and a molecular weight of 295.41 g/mol. Its IUPAC name is 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine
PubChem CID24508226
Molecular FormulaC17H17N3S
Molecular Weight295.41 g/mol
Exact Mass295.11
IUPAC Name4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine
SMILESCCC1c2ccsc2CCN1c1ncnc2ccccc12
InChIInChI=1S/C17H17N3S/c1-2-15-13-8-10-21-16(13)7-9-20(15)17-12-5-3-4-6-14(12)18-11-19-17/h3-6,8,10-11,15H,2,7,9H2,1H3
InChIKeyOWZCUNHMHRFBBL-UHFFFAOYSA-N
XLogP4.21
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(6-chloro-5-ethylpyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 63729324
(4S)-4-methyl-5-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 25316000
5-(6-chloro-5-propylpyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 63729322
5-(6-chloro-5-methylpyrimidin-4-yl)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 63729494
3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoxalin-2-amine
CID 102985686
2-amino-1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-one;hydrochloride
CID 119294015
(2S)-2-amino-1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-one
CID 61146658
3-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-8-methylquinazolin-4-one
CID 51270851
4-(2-methylpiperazin-1-yl)quinazoline
CID 62673888
2-amino-1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-2-ylethanone
CID 115286639
(4R)-N-(1,3-benzothiazol-2-yl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 38280106
N-(1,3-benzothiazol-2-yl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 71898973

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The IUPAC name of 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine (CID 24508226) is 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine.
What is the SMILES notation for 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The canonical SMILES for 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine is CCC1c2ccsc2CCN1c1ncnc2ccccc12.
What is the InChIKey of 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
The InChIKey is OWZCUNHMHRFBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3S/c1-2-15-13-8-10-21-16(13)7-9-20(15)17-12-5-3-4-6-14(12)18-11-19-17/h3-6,8,10-11,15H,2,7,9H2,1H3.
What are the key properties of 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine?
4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine has a molecular weight of 295.41 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-quinazolin-4-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine is sourced from PubChem (CID 24508226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).