(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone

C19H20N4O2 — CID 21192745

IUPAC(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone
SMILESNC1=NC2(CCN(C(=O)c3ccc(O)cc3)CC2)Nc2ccccc21
InChIInChI=1S/C19H20N4O2/c20-17-15-3-1-2-4-16(15)21-19(22-17)9-11-23(12-10-19)18(25)13-5-7-14(24)8-6-13/h1-8,21,24H,9-12H2,(H2,20,22)
InChIKeySHNYHFLREPIZEE-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.16
Rot. Bonds1

About (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone

(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone (PubChem CID 21192745) has the molecular formula C19H20N4O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone.

Molecular Properties

Compound Name(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone
PubChem CID21192745
Molecular FormulaC19H20N4O2
Molecular Weight336.39 g/mol
Exact Mass336.16
IUPAC Name(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone
SMILESNC1=NC2(CCN(C(=O)c3ccc(O)cc3)CC2)Nc2ccccc21
InChIInChI=1S/C19H20N4O2/c20-17-15-3-1-2-4-16(15)21-19(22-17)9-11-23(12-10-19)18(25)13-5-7-14(24)8-6-13/h1-8,21,24H,9-12H2,(H2,20,22)
InChIKeySHNYHFLREPIZEE-UHFFFAOYSA-N
XLogP2.16
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)benzenesulfonamide
CID 21192867
(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-methoxyphenyl)methanone;hydrochloride
CID 67568356
phenyl 4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate
CID 21192752
4-(4-amino-5-hydroxyspiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)benzonitrile
CID 135845139
4-(4-amino-5-fluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)-N-(2-hydroxyphenyl)benzamide
CID 54170243
4-(4-amino-5,7-difluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carbonyl)benzonitrile
CID 21192859
1'-methylsulfonylspiro[1H-quinazoline-2,4'-piperidine]-4-amine
CID 10859364
(4-amino-5-fluorospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(3,4-dichlorophenyl)methanone
CID 21192876
(4-amino-5-fluorospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(1,3-benzodioxol-5-yl)methanone
CID 21192818
8-(4-fluorobenzoyl)-3-phenyl-1,4,8-triazaspiro[4.5]dec-3-en-2-one
CID 20911460
1'-(naphthalene-2-carbonyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one
CID 46077696
8-(4-fluorobenzoyl)-3-(4-fluorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
CID 20911545

Frequently Asked Questions

What is the IUPAC name of (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone?
The IUPAC name of (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone (CID 21192745) is (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone.
What is the SMILES notation for (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone?
The canonical SMILES for (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone is NC1=NC2(CCN(C(=O)c3ccc(O)cc3)CC2)Nc2ccccc21.
What is the InChIKey of (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone?
The InChIKey is SHNYHFLREPIZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c20-17-15-3-1-2-4-16(15)21-19(22-17)9-11-23(12-10-19)18(25)13-5-7-14(24)8-6-13/h1-8,21,24H,9-12H2,(H2,20,22).
What are the key properties of (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone?
(4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone has a molecular weight of 336.39 g/mol, XLogP of 2.16, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminospiro[1H-quinazoline-2,4'-piperidine]-1'-yl)-(4-hydroxyphenyl)methanone is sourced from PubChem (CID 21192745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).