N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine

C15H15N3S — CID 114788976

IUPACN-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine
SMILESCC(Cc1ccsc1)Nc1ncc2ccccc2n1
InChIInChI=1S/C15H15N3S/c1-11(8-12-6-7-19-10-12)17-15-16-9-13-4-2-3-5-14(13)18-15/h2-7,9-11H,8H2,1H3,(H,16,17,18)
InChIKeyBRROVFQHIMFPTH-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.73
Rot. Bonds4

About N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine

N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine (PubChem CID 114788976) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine.

Molecular Properties

Compound NameN-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine
PubChem CID114788976
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine
SMILESCC(Cc1ccsc1)Nc1ncc2ccccc2n1
InChIInChI=1S/C15H15N3S/c1-11(8-12-6-7-19-10-12)17-15-16-9-13-4-2-3-5-14(13)18-15/h2-7,9-11H,8H2,1H3,(H,16,17,18)
InChIKeyBRROVFQHIMFPTH-UHFFFAOYSA-N
XLogP3.73
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-methyl-2-(1-thiophen-3-ylpropan-2-ylamino)pyrimidin-5-yl]ethanone
CID 135109399
N-(4-bromopentan-2-yl)quinazolin-2-amine
CID 114789890
4-methoxy-N-(1-thiophen-3-ylpropan-2-yl)pyrimidin-2-amine
CID 112686316
4-N-(1-thiophen-3-ylpropan-2-yl)quinazoline-2,4-diamine
CID 80800246
6-methyl-N-(1-thiophen-3-ylpropan-2-yl)pyridin-3-amine
CID 115921558
6-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 63588798
5-fluoro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 61474267
4-hydrazinyl-6-propoxy-N-(1-thiophen-3-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 80901076
1,5-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazol-4-amine
CID 115923213
N-[(1-methylbenzimidazol-2-yl)methyl]-1-thiophen-3-ylpropan-2-amine
CID 63001491
3-(1-thiophen-3-ylpropan-2-ylamino)pyridine-4-carbothioamide
CID 114288308
6-(1-thiophen-3-ylpropan-2-ylamino)pyridine-3-carbonitrile
CID 47357833

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine?
The IUPAC name of N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine (CID 114788976) is N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine.
What is the SMILES notation for N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine?
The canonical SMILES for N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine is CC(Cc1ccsc1)Nc1ncc2ccccc2n1.
What is the InChIKey of N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine?
The InChIKey is BRROVFQHIMFPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-11(8-12-6-7-19-10-12)17-15-16-9-13-4-2-3-5-14(13)18-15/h2-7,9-11H,8H2,1H3,(H,16,17,18).
What are the key properties of N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine?
N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine has a molecular weight of 269.37 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-3-ylpropan-2-yl)quinazolin-2-amine is sourced from PubChem (CID 114788976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).