1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol

C15H20N4O — CID 106835289

IUPAC1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(c2ncnc3cc(N)ccc23)CC1
InChIInChI=1S/C15H20N4O/c1-10(20)11-4-6-19(7-5-11)15-13-3-2-12(16)8-14(13)17-9-18-15/h2-3,8-11,20H,4-7,16H2,1H3
InChIKeyIKUHRUGAWOFABY-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.81
Rot. Bonds2

About 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol

1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol (PubChem CID 106835289) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol
PubChem CID106835289
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(c2ncnc3cc(N)ccc23)CC1
InChIInChI=1S/C15H20N4O/c1-10(20)11-4-6-19(7-5-11)15-13-3-2-12(16)8-14(13)17-9-18-15/h2-3,8-11,20H,4-7,16H2,1H3
InChIKeyIKUHRUGAWOFABY-UHFFFAOYSA-N
XLogP1.81
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(4-propan-2-ylpiperidin-1-yl)quinazolin-7-amine
CID 103505104
4-(azepan-1-yl)quinazolin-7-amine
CID 65336850
4-(azocan-1-yl)quinazolin-7-amine
CID 65337382
4-(3,4,5-trimethylpiperazin-1-yl)quinazolin-7-amine
CID 114543048
4-(4-ethylpiperidin-1-yl)quinazolin-6-amine
CID 64589288
4-(3,4-dimethoxypyrrolidin-1-yl)quinazolin-7-amine
CID 103530590
4-(3,5-dimethylpiperidin-1-yl)quinazolin-7-amine
CID 65337141
1-[4-(7-aminoquinazolin-4-yl)-1,4-diazepan-1-yl]ethanone
CID 65336927
1-(7-aminoquinazolin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103194356
1-[1-(6-amino-5-ethylpyrimidin-4-yl)piperidin-4-yl]ethanol
CID 106839793
4-(3-ethyl-4-methylpiperazin-1-yl)quinazolin-7-amine
CID 65337182
4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine
CID 103505187

Frequently Asked Questions

What is the IUPAC name of 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol (CID 106835289) is 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol is CC(O)C1CCN(c2ncnc3cc(N)ccc23)CC1.
What is the InChIKey of 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol?
The InChIKey is IKUHRUGAWOFABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10(20)11-4-6-19(7-5-11)15-13-3-2-12(16)8-14(13)17-9-18-15/h2-3,8-11,20H,4-7,16H2,1H3.
What are the key properties of 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol?
1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol has a molecular weight of 272.35 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(7-aminoquinazolin-4-yl)piperidin-4-yl]ethanol is sourced from PubChem (CID 106835289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).