4-[2-(quinazolin-4-ylamino)ethyl]phenol

C16H15N3O — CID 24742057

IUPAC4-[2-(quinazolin-4-ylamino)ethyl]phenol
SMILESOc1ccc(CCNc2ncnc3ccccc23)cc1
InChIInChI=1S/C16H15N3O/c20-13-7-5-12(6-8-13)9-10-17-16-14-3-1-2-4-15(14)18-11-19-16/h1-8,11,20H,9-10H2,(H,17,18,19)
InChIKeyJHOJFXLJJVFCBO-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.99
Rot. Bonds4

About 4-[2-(quinazolin-4-ylamino)ethyl]phenol

4-[2-(quinazolin-4-ylamino)ethyl]phenol (PubChem CID 24742057) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-[2-(quinazolin-4-ylamino)ethyl]phenol.

Molecular Properties

Compound Name4-[2-(quinazolin-4-ylamino)ethyl]phenol
PubChem CID24742057
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-[2-(quinazolin-4-ylamino)ethyl]phenol
SMILESOc1ccc(CCNc2ncnc3ccccc23)cc1
InChIInChI=1S/C16H15N3O/c20-13-7-5-12(6-8-13)9-10-17-16-14-3-1-2-4-15(14)18-11-19-16/h1-8,11,20H,9-10H2,(H,17,18,19)
InChIKeyJHOJFXLJJVFCBO-UHFFFAOYSA-N
XLogP2.99
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[4-(methoxymethyl)phenyl]ethyl]quinazolin-4-amine
CID 67597997
2-[2-[2-(quinazolin-4-ylamino)ethyl]phenyl]ethanol
CID 67890696
N-[2-(3,4-dimethoxyphenyl)ethyl]quinazolin-4-amine
CID 701177
4-(3-phenylpropylamino)quinazolin-7-ol
CID 137026727
4-[2-(thieno[2,3-d]pyrimidin-4-ylamino)ethyl]phenol
CID 47060280
N-(4-hydroxyphenyl)-3-(quinazolin-4-ylamino)propanamide
CID 110437211
N-(2-phenylmethoxyethyl)quinazolin-4-amine
CID 12928829
4-[2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]phenol
CID 47295068
4-[2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethyl]phenol
CID 28850872
4-[2-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethyl]phenol
CID 80898704
2-[2-(quinazolin-4-ylamino)ethoxy]ethanol
CID 7140376
N-[2-(5-bromofuran-2-yl)ethyl]quinazolin-4-amine
CID 133375086

Frequently Asked Questions

What is the IUPAC name of 4-[2-(quinazolin-4-ylamino)ethyl]phenol?
The IUPAC name of 4-[2-(quinazolin-4-ylamino)ethyl]phenol (CID 24742057) is 4-[2-(quinazolin-4-ylamino)ethyl]phenol.
What is the SMILES notation for 4-[2-(quinazolin-4-ylamino)ethyl]phenol?
The canonical SMILES for 4-[2-(quinazolin-4-ylamino)ethyl]phenol is Oc1ccc(CCNc2ncnc3ccccc23)cc1.
What is the InChIKey of 4-[2-(quinazolin-4-ylamino)ethyl]phenol?
The InChIKey is JHOJFXLJJVFCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c20-13-7-5-12(6-8-13)9-10-17-16-14-3-1-2-4-15(14)18-11-19-16/h1-8,11,20H,9-10H2,(H,17,18,19).
What are the key properties of 4-[2-(quinazolin-4-ylamino)ethyl]phenol?
4-[2-(quinazolin-4-ylamino)ethyl]phenol has a molecular weight of 265.32 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(quinazolin-4-ylamino)ethyl]phenol is sourced from PubChem (CID 24742057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).