2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol

C19H17N3O2S — CID 133323931

IUPAC2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol
SMILESCC(O)(CNc1nc(-c2ccsc2)nc2ccccc12)c1ccco1
InChIInChI=1S/C19H17N3O2S/c1-19(23,16-7-4-9-24-16)12-20-18-14-5-2-3-6-15(14)21-17(22-18)13-8-10-25-11-13/h2-11,23H,12H2,1H3,(H,20,21,22)
InChIKeyJWWOLPDDTHJUGR-UHFFFAOYSA-N
MW351.43 g/mol
LogP4.27
Rot. Bonds5

About 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol

2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol (PubChem CID 133323931) has the molecular formula C19H17N3O2S and a molecular weight of 351.43 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol.

Molecular Properties

Compound Name2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol
PubChem CID133323931
Molecular FormulaC19H17N3O2S
Molecular Weight351.43 g/mol
Exact Mass351.10
IUPAC Name2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol
SMILESCC(O)(CNc1nc(-c2ccsc2)nc2ccccc12)c1ccco1
InChIInChI=1S/C19H17N3O2S/c1-19(23,16-7-4-9-24-16)12-20-18-14-5-2-3-6-15(14)21-17(22-18)13-8-10-25-11-13/h2-11,23H,12H2,1H3,(H,20,21,22)
InChIKeyJWWOLPDDTHJUGR-UHFFFAOYSA-N
XLogP4.27
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol with MolForge

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Related Compounds

methyl 3-[(2-thiophen-3-ylquinazolin-4-yl)amino]propanoate
CID 71902211
2-(furan-2-yl)-1-[(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 133323807
N-prop-2-ynyl-2-[(2-thiophen-3-ylquinazolin-4-yl)amino]acetamide
CID 49430506
N-(3-methoxypropyl)-2-thiophen-3-ylquinazolin-4-amine
CID 78805402
N',N'-dimethyl-N-(2-thiophen-3-ylquinazolin-4-yl)propane-1,3-diamine
CID 156820966
N-(1,3-thiazol-4-ylmethyl)-2-thiophen-3-ylquinazolin-4-amine
CID 49430846
N-[4-[[(2-thiophen-3-ylquinazolin-4-yl)amino]methyl]phenyl]acetamide
CID 24632870
[(3R,4R)-4-[(2-thiophen-3-ylquinazolin-4-yl)amino]oxolan-3-yl]methanol
CID 166260662
N-[2-(furan-2-yl)-2-hydroxypropyl]thiophene-3-carboxamide
CID 71782534
N-pyridin-2-yl-2-[(2-thiophen-3-ylquinazolin-4-yl)amino]acetamide
CID 133367580
N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylethyl]-2-thiophen-3-ylquinazolin-4-amine
CID 36834207
N-[(2R)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]-2-thiophen-3-ylquinazolin-4-amine
CID 30725151

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol?
The IUPAC name of 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol (CID 133323931) is 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol.
What is the SMILES notation for 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol?
The canonical SMILES for 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol is CC(O)(CNc1nc(-c2ccsc2)nc2ccccc12)c1ccco1.
What is the InChIKey of 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol?
The InChIKey is JWWOLPDDTHJUGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2S/c1-19(23,16-7-4-9-24-16)12-20-18-14-5-2-3-6-15(14)21-17(22-18)13-8-10-25-11-13/h2-11,23H,12H2,1H3,(H,20,21,22).
What are the key properties of 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol?
2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol has a molecular weight of 351.43 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-[(2-thiophen-3-ylquinazolin-4-yl)amino]propan-2-ol is sourced from PubChem (CID 133323931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).